Organoheterocyclic compounds
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3-Amino-2-chloropyridine, 96%
CAS: 6298-19-7 Molecular Formula: C5H5ClN2 Molecular Weight (g/mol): 128.56 MDL Number: MFCD00006238 InChI Key: MEQBJJUWDCYIAB-UHFFFAOYSA-N Synonym: 3-amino-2-chloropyridine,2-chloro-3-aminopyridine,2-chloro-3-pyridinamine,3-pyridinamine, 2-chloro,2-chloro-3-amino pyridine,2-chloro-3-pyridylamine,2-chloro-3-amino-pyridine,2-chloro-pyridin-3-ylamine,2-chloro-3-pyridinylamine,3-amino-2-chloro-pyridine PubChem CID: 80528 IUPAC Name: 2-chloropyridin-3-amine SMILES: NC1=CC=CN=C1Cl
| PubChem CID | 80528 |
|---|---|
| CAS | 6298-19-7 |
| Molecular Weight (g/mol) | 128.56 |
| MDL Number | MFCD00006238 |
| SMILES | NC1=CC=CN=C1Cl |
| Synonym | 3-amino-2-chloropyridine,2-chloro-3-aminopyridine,2-chloro-3-pyridinamine,3-pyridinamine, 2-chloro,2-chloro-3-amino pyridine,2-chloro-3-pyridylamine,2-chloro-3-amino-pyridine,2-chloro-pyridin-3-ylamine,2-chloro-3-pyridinylamine,3-amino-2-chloro-pyridine |
| IUPAC Name | 2-chloropyridin-3-amine |
| InChI Key | MEQBJJUWDCYIAB-UHFFFAOYSA-N |
| Molecular Formula | C5H5ClN2 |
2,3-Dihydro-1,4-benzodioxine-6-carbaldehyde 97%, Thermo Scientific™
CAS: 29668-44-8 Molecular Formula: C9H8O3 Molecular Weight (g/mol): 164.16 InChI Key: CWKXDPPQCVWXAG-UHFFFAOYSA-N Synonym: 1,4-benzodioxan-6-carboxaldehyde,1,4-benzodioxan-6-carbaldehyde,2,3-dihydrobenzo b 1,4 dioxine-6-carbaldehyde,1,4-benzodioxane-6-carboxaldehyde,3,4-ethylenedioxybenzaldehyde,1,4-benzodioxin-6-carboxaldehyde, 2,3-dihydro,7-formyl-1,4-benzodioxane,1,4-benzodioxane-6-aldehyde,2,3-dihydro-1,4-benzodioxin-6-carbaldehyde,1,4-benzodioxane-6-carbaldehyde PubChem CID: 248127 IUPAC Name: 2,3-dihydro-1,4-benzodioxine-6-carbaldehyde SMILES: C1COC2=C(O1)C=CC(=C2)C=O
| PubChem CID | 248127 |
|---|---|
| CAS | 29668-44-8 |
| Molecular Weight (g/mol) | 164.16 |
| SMILES | C1COC2=C(O1)C=CC(=C2)C=O |
| Synonym | 1,4-benzodioxan-6-carboxaldehyde,1,4-benzodioxan-6-carbaldehyde,2,3-dihydrobenzo b 1,4 dioxine-6-carbaldehyde,1,4-benzodioxane-6-carboxaldehyde,3,4-ethylenedioxybenzaldehyde,1,4-benzodioxin-6-carboxaldehyde, 2,3-dihydro,7-formyl-1,4-benzodioxane,1,4-benzodioxane-6-aldehyde,2,3-dihydro-1,4-benzodioxin-6-carbaldehyde,1,4-benzodioxane-6-carbaldehyde |
| IUPAC Name | 2,3-dihydro-1,4-benzodioxine-6-carbaldehyde |
| InChI Key | CWKXDPPQCVWXAG-UHFFFAOYSA-N |
| Molecular Formula | C9H8O3 |
2-Chloropyridine N-oxide hydrochloride, 97%
CAS: 20295-64-1 Molecular Formula: C5H5Cl2NO Molecular Weight (g/mol): 166.001 MDL Number: MFCD00007913 InChI Key: GRZNODNSNCXOHE-UHFFFAOYSA-N Synonym: 2-chloropyridine n-oxide hydrochloride,2-chloropyridine-n-oxide hydrochloride,2-chloropyridine 1-oxide hydrochloride,chloride 2-chloropyridinium 1-oxide,2-chloropyridine n-oxide hcl,pyridine, 2-chloro-, 1-oxide, hydrochloride,2-chloropyridin-1-ium-1-olate hydrochloride,2-chlorpyridin-1-oxidhydrochlorid,acmc-1ccui,2-chloropyridine n-oxide.hcl PubChem CID: 88478 IUPAC Name: 2-chloro-1-oxidopyridin-1-ium;hydrochloride SMILES: C1=CC=[N+](C(=C1)Cl)[O-].Cl
| PubChem CID | 88478 |
|---|---|
| CAS | 20295-64-1 |
| Molecular Weight (g/mol) | 166.001 |
| MDL Number | MFCD00007913 |
| SMILES | C1=CC=[N+](C(=C1)Cl)[O-].Cl |
| Synonym | 2-chloropyridine n-oxide hydrochloride,2-chloropyridine-n-oxide hydrochloride,2-chloropyridine 1-oxide hydrochloride,chloride 2-chloropyridinium 1-oxide,2-chloropyridine n-oxide hcl,pyridine, 2-chloro-, 1-oxide, hydrochloride,2-chloropyridin-1-ium-1-olate hydrochloride,2-chlorpyridin-1-oxidhydrochlorid,acmc-1ccui,2-chloropyridine n-oxide.hcl |
| IUPAC Name | 2-chloro-1-oxidopyridin-1-ium;hydrochloride |
| InChI Key | GRZNODNSNCXOHE-UHFFFAOYSA-N |
| Molecular Formula | C5H5Cl2NO |
Imidazo[1,2-a]pyridine, 99%
CAS: 274-76-0 Molecular Formula: C7H6N2 Molecular Weight (g/mol): 118.14 MDL Number: MFCD00005553 InChI Key: UTCSSFWDNNEEBH-UHFFFAOYSA-N Synonym: imidazo 1,2-a pyridine,unii-g18zbv2hxa,1h-imidazo 1,2-a pyridine,g18zbv2hxa,pyrimidazole,1-azaindolizine,1,3a-diazaindene,pubchem17181,imidazo l,2-a pyridine PubChem CID: 78960 IUPAC Name: imidazo[1,2-a]pyridine SMILES: C1=CN2C=CC=CC2=N1
| PubChem CID | 78960 |
|---|---|
| CAS | 274-76-0 |
| Molecular Weight (g/mol) | 118.14 |
| MDL Number | MFCD00005553 |
| SMILES | C1=CN2C=CC=CC2=N1 |
| Synonym | imidazo 1,2-a pyridine,unii-g18zbv2hxa,1h-imidazo 1,2-a pyridine,g18zbv2hxa,pyrimidazole,1-azaindolizine,1,3a-diazaindene,pubchem17181,imidazo l,2-a pyridine |
| IUPAC Name | imidazo[1,2-a]pyridine |
| InChI Key | UTCSSFWDNNEEBH-UHFFFAOYSA-N |
| Molecular Formula | C7H6N2 |
Pyrazine, 99+% (dry wt.) water <1.0%
CAS: 290-37-9 Molecular Formula: C4H4N2 Molecular Weight (g/mol): 80.09 MDL Number: MFCD00006122 InChI Key: KYQCOXFCLRTKLS-UHFFFAOYSA-N Synonym: 1,4-diazine,p-diazine,paradiazine,piazine,1,4-diazabenzene,pyrazin,ccris 1331,1,4-diazin,mixture,mu-pyrazine; PubChem CID: 9261 ChEBI: CHEBI:30953 IUPAC Name: pyrazine SMILES: C1=CN=CC=N1
| PubChem CID | 9261 |
|---|---|
| CAS | 290-37-9 |
| Molecular Weight (g/mol) | 80.09 |
| ChEBI | CHEBI:30953 |
| MDL Number | MFCD00006122 |
| SMILES | C1=CN=CC=N1 |
| Synonym | 1,4-diazine,p-diazine,paradiazine,piazine,1,4-diazabenzene,pyrazin,ccris 1331,1,4-diazin,mixture,mu-pyrazine; |
| IUPAC Name | pyrazine |
| InChI Key | KYQCOXFCLRTKLS-UHFFFAOYSA-N |
| Molecular Formula | C4H4N2 |
1-Chloro-4-phenylphthalazine, 96%
CAS: 10132-01-1 Molecular Formula: C14H9ClN2 Molecular Weight (g/mol): 240.69 MDL Number: MFCD00524786 InChI Key: WJJDLSHYLZRFDD-UHFFFAOYSA-N Synonym: 1-chloro-4-phenyl-phthalazine,phthalazine,1-chloro-4-phenyl,4-chloro-1-phenylphthalazine PubChem CID: 272109 IUPAC Name: 1-chloro-4-phenylphthalazine SMILES: C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)Cl
| PubChem CID | 272109 |
|---|---|
| CAS | 10132-01-1 |
| Molecular Weight (g/mol) | 240.69 |
| MDL Number | MFCD00524786 |
| SMILES | C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)Cl |
| Synonym | 1-chloro-4-phenyl-phthalazine,phthalazine,1-chloro-4-phenyl,4-chloro-1-phenylphthalazine |
| IUPAC Name | 1-chloro-4-phenylphthalazine |
| InChI Key | WJJDLSHYLZRFDD-UHFFFAOYSA-N |
| Molecular Formula | C14H9ClN2 |
5,5'-Dibromo-2,2'-bithiophene, 98%
CAS: 4805-22-5 Molecular Formula: C8H4Br2S2 Molecular Weight (g/mol): 324.048 MDL Number: MFCD00219110 InChI Key: SXNCMLQAQIGJDO-UHFFFAOYSA-N Synonym: 5,5'-dibromo-2,2'-bithiophene,2-bromo-5-5-bromothiophen-2-yl thiophene,5,5-dibromo-2,2-bithiophene,2,2'-bithiophene, 5,5'-dibromo,5,5'-bis 2-bromothiophene,5,5'-dibromo-2,2'bithiophene,5,5'-dibromo-2,2-bithiophene,maybridge4_002009,acmc-209kc4,ksc491i4r PubChem CID: 638908 IUPAC Name: 2-bromo-5-(5-bromothiophen-2-yl)thiophene SMILES: C1=C(SC(=C1)Br)C2=CC=C(S2)Br
| PubChem CID | 638908 |
|---|---|
| CAS | 4805-22-5 |
| Molecular Weight (g/mol) | 324.048 |
| MDL Number | MFCD00219110 |
| SMILES | C1=C(SC(=C1)Br)C2=CC=C(S2)Br |
| Synonym | 5,5'-dibromo-2,2'-bithiophene,2-bromo-5-5-bromothiophen-2-yl thiophene,5,5-dibromo-2,2-bithiophene,2,2'-bithiophene, 5,5'-dibromo,5,5'-bis 2-bromothiophene,5,5'-dibromo-2,2'bithiophene,5,5'-dibromo-2,2-bithiophene,maybridge4_002009,acmc-209kc4,ksc491i4r |
| IUPAC Name | 2-bromo-5-(5-bromothiophen-2-yl)thiophene |
| InChI Key | SXNCMLQAQIGJDO-UHFFFAOYSA-N |
| Molecular Formula | C8H4Br2S2 |
4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole-1-carboxylic Acid Tert-Butyl Ester, 97%
CAS: 552846-17-0 Molecular Formula: C14H23BN2O4 Molecular Weight (g/mol): 294.16 MDL Number: MFCD05663873 InChI Key: IPISOFJLWYBCAV-UHFFFAOYSA-N Synonym: 1-boc-pyrazole-4-boronic acid pinacol ester,tert-butyl 4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrazole-1-carboxylate,1-boc-4-pyrazoleboronic acid pinacol ester,1-boc-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyrazole,tert-butyl 4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyrazole-1-carboxylate,n-boc-pyrazole-4-boronic acid pinacol ester,1-tert-butoxycarbonyl-1h-pyrazole-4-boronic acid, pinacol ester,n-boc-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-pyrazole,1-tert-butoxycarbonyl-1h-pyrazol-4-yl boronic acid pinacol ester,1-tert-butoxycarbonyl-4-1h-pyrazoleboronic acid PubChem CID: 16217654 IUPAC Name: tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole-1-carboxylate SMILES: CC(C)(C)OC(=O)N1C=C(C=N1)B1OC(C)(C)C(C)(C)O1
| PubChem CID | 16217654 |
|---|---|
| CAS | 552846-17-0 |
| Molecular Weight (g/mol) | 294.16 |
| MDL Number | MFCD05663873 |
| SMILES | CC(C)(C)OC(=O)N1C=C(C=N1)B1OC(C)(C)C(C)(C)O1 |
| Synonym | 1-boc-pyrazole-4-boronic acid pinacol ester,tert-butyl 4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-1h-pyrazole-1-carboxylate,1-boc-4-pyrazoleboronic acid pinacol ester,1-boc-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyrazole,tert-butyl 4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyrazole-1-carboxylate,n-boc-pyrazole-4-boronic acid pinacol ester,1-tert-butoxycarbonyl-1h-pyrazole-4-boronic acid, pinacol ester,n-boc-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-pyrazole,1-tert-butoxycarbonyl-1h-pyrazol-4-yl boronic acid pinacol ester,1-tert-butoxycarbonyl-4-1h-pyrazoleboronic acid |
| IUPAC Name | tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole-1-carboxylate |
| InChI Key | IPISOFJLWYBCAV-UHFFFAOYSA-N |
| Molecular Formula | C14H23BN2O4 |
2-Oxazolidinone, 99%
CAS: 497-25-6 Molecular Formula: C3H5NO2 Molecular Weight (g/mol): 87.08 MDL Number: MFCD00005268 InChI Key: IZXIZTKNFFYFOF-UHFFFAOYSA-N Synonym: 2-oxazolidone,oxazolidin-2-one,2-oxazolidinone,oxazolidinone,oxazolidone,oxazolidinones,unii-z4d49w92pp,carbamic acid, 2-hydroxyethyl-, gamma-lactone,wln: t5mvotj,carbamic acid, .gamma.-lactone PubChem CID: 73949 ChEBI: CHEBI:1237 IUPAC Name: 1,3-oxazolidin-2-one SMILES: O=C1NCCO1
| PubChem CID | 73949 |
|---|---|
| CAS | 497-25-6 |
| Molecular Weight (g/mol) | 87.08 |
| ChEBI | CHEBI:1237 |
| MDL Number | MFCD00005268 |
| SMILES | O=C1NCCO1 |
| Synonym | 2-oxazolidone,oxazolidin-2-one,2-oxazolidinone,oxazolidinone,oxazolidone,oxazolidinones,unii-z4d49w92pp,carbamic acid, 2-hydroxyethyl-, gamma-lactone,wln: t5mvotj,carbamic acid, .gamma.-lactone |
| IUPAC Name | 1,3-oxazolidin-2-one |
| InChI Key | IZXIZTKNFFYFOF-UHFFFAOYSA-N |
| Molecular Formula | C3H5NO2 |
4-Amino-3-chloropyridine, 97%
CAS: 19798-77-7 Molecular Formula: C5H5ClN2 Molecular Weight (g/mol): 128.559 MDL Number: MFCD03984473 InChI Key: KJBKPRMEMJKXDV-UHFFFAOYSA-N Synonym: 4-amino-3-chloropyridine,3-chloro-pyridin-4-ylamine,3-chloro-4-pyridinamine,3-chloro-4-aminopyridine,3-chloro-4-pyridinylamine,4-pyridinamine, 3-chloro,3-chloro-4-pyridinamin,3-chloro-4-pyridylamine,4-amino-3-chloro-pyridine,pubchem6653 PubChem CID: 581853 IUPAC Name: 3-chloropyridin-4-amine SMILES: C1=CN=CC(=C1N)Cl
| PubChem CID | 581853 |
|---|---|
| CAS | 19798-77-7 |
| Molecular Weight (g/mol) | 128.559 |
| MDL Number | MFCD03984473 |
| SMILES | C1=CN=CC(=C1N)Cl |
| Synonym | 4-amino-3-chloropyridine,3-chloro-pyridin-4-ylamine,3-chloro-4-pyridinamine,3-chloro-4-aminopyridine,3-chloro-4-pyridinylamine,4-pyridinamine, 3-chloro,3-chloro-4-pyridinamin,3-chloro-4-pyridylamine,4-amino-3-chloro-pyridine,pubchem6653 |
| IUPAC Name | 3-chloropyridin-4-amine |
| InChI Key | KJBKPRMEMJKXDV-UHFFFAOYSA-N |
| Molecular Formula | C5H5ClN2 |
2-Amino-3-fluoro-5-(trifluoromethyl)pyridine, 97%
CAS: 852062-17-0 Molecular Formula: C6H4F4N2 Molecular Weight (g/mol): 180.106 MDL Number: MFCD10699117 InChI Key: HAVVQRHBCUBQGG-UHFFFAOYSA-N Synonym: 2-amino-3-fluoro-5-trifluoromethyl pyridine,3-fluoro-5-trifluoromethyl pyridin-2-amine,2-amino-3-fluoro-5-trifluoromethylpyridine,3-fluoro-5-trifluoromethyl-2-pyridylamine,3-fluoro-5-trifluoromethyl pyridine-2-amine,3-fluoro-5-trifluoromethyl-2-pyridinamine PubChem CID: 25067349 IUPAC Name: 3-fluoro-5-(trifluoromethyl)pyridin-2-amine SMILES: C1=C(C=NC(=C1F)N)C(F)(F)F
| PubChem CID | 25067349 |
|---|---|
| CAS | 852062-17-0 |
| Molecular Weight (g/mol) | 180.106 |
| MDL Number | MFCD10699117 |
| SMILES | C1=C(C=NC(=C1F)N)C(F)(F)F |
| Synonym | 2-amino-3-fluoro-5-trifluoromethyl pyridine,3-fluoro-5-trifluoromethyl pyridin-2-amine,2-amino-3-fluoro-5-trifluoromethylpyridine,3-fluoro-5-trifluoromethyl-2-pyridylamine,3-fluoro-5-trifluoromethyl pyridine-2-amine,3-fluoro-5-trifluoromethyl-2-pyridinamine |
| IUPAC Name | 3-fluoro-5-(trifluoromethyl)pyridin-2-amine |
| InChI Key | HAVVQRHBCUBQGG-UHFFFAOYSA-N |
| Molecular Formula | C6H4F4N2 |
Pyrimidine, 99%
CAS: 289-95-2 Molecular Formula: C4H4N2 Molecular Weight (g/mol): 80.09 MDL Number: MFCD00006059 InChI Key: CZPWVGJYEJSRLH-UHFFFAOYSA-N Synonym: 1,3-diazine,metadiazine,m-diazine,miazine,1,3-diazabenzene,base,1,3-diazin,pyrimidin,unii-k8cxk5q32l,k8cxk5q32l PubChem CID: 9260 ChEBI: CHEBI:16898 IUPAC Name: pyrimidine SMILES: C1=CN=CN=C1
| PubChem CID | 9260 |
|---|---|
| CAS | 289-95-2 |
| Molecular Weight (g/mol) | 80.09 |
| ChEBI | CHEBI:16898 |
| MDL Number | MFCD00006059 |
| SMILES | C1=CN=CN=C1 |
| Synonym | 1,3-diazine,metadiazine,m-diazine,miazine,1,3-diazabenzene,base,1,3-diazin,pyrimidin,unii-k8cxk5q32l,k8cxk5q32l |
| IUPAC Name | pyrimidine |
| InChI Key | CZPWVGJYEJSRLH-UHFFFAOYSA-N |
| Molecular Formula | C4H4N2 |
3,4-Diaminofurazan, 97%
CAS: 17220-38-1 Molecular Formula: C2H4N4O Molecular Weight (g/mol): 100.08 MDL Number: MFCD00138084 InChI Key: JHJVSUCUNFXIHN-UHFFFAOYSA-N Synonym: 3,4-diaminofurazan,furazandiamine,3,4-diamino-1,2,5-oxadiazole,diaminofurazan,4,5-diaminofurazan,3,4-diaminofurazane,furazan-3,4-diamine,pubchem21086,# PubChem CID: 537677 IUPAC Name: 1,2,5-oxadiazole-3,4-diamine SMILES: C1(=NON=C1N)N
| PubChem CID | 537677 |
|---|---|
| CAS | 17220-38-1 |
| Molecular Weight (g/mol) | 100.08 |
| MDL Number | MFCD00138084 |
| SMILES | C1(=NON=C1N)N |
| Synonym | 3,4-diaminofurazan,furazandiamine,3,4-diamino-1,2,5-oxadiazole,diaminofurazan,4,5-diaminofurazan,3,4-diaminofurazane,furazan-3,4-diamine,pubchem21086,# |
| IUPAC Name | 1,2,5-oxadiazole-3,4-diamine |
| InChI Key | JHJVSUCUNFXIHN-UHFFFAOYSA-N |
| Molecular Formula | C2H4N4O |
Methyl 6-bromo-5-fluoronicotinate, 98%
CAS: 1214336-88-5 Molecular Formula: C7H5BrFNO2 Molecular Weight (g/mol): 234.02 MDL Number: MFCD14698110 InChI Key: PXHKAVXJQLVUBI-UHFFFAOYSA-N Synonym: methyl 6-bromo-5-fluoronicotinate,6-bromo-5-fluoro-nicotinic acid methyl ester,2-bromo-3-fluoro-5-methoxycarbonyl pyridine,methyl6-bromo-5-fluoronicotinate,abbypharma ap-30-7441,6-bromo-5-fluoropyridine-3-carboxylate,methyl 2-bromo-3-fluoro-5-pyridinecarboxylate,3-pyridinecarboxylic acid, 6-bromo-5-fluoro-, methyl ester PubChem CID: 46311203 IUPAC Name: methyl 6-bromo-5-fluoropyridine-3-carboxylate SMILES: COC(=O)C1=CC(F)=C(Br)N=C1
| PubChem CID | 46311203 |
|---|---|
| CAS | 1214336-88-5 |
| Molecular Weight (g/mol) | 234.02 |
| MDL Number | MFCD14698110 |
| SMILES | COC(=O)C1=CC(F)=C(Br)N=C1 |
| Synonym | methyl 6-bromo-5-fluoronicotinate,6-bromo-5-fluoro-nicotinic acid methyl ester,2-bromo-3-fluoro-5-methoxycarbonyl pyridine,methyl6-bromo-5-fluoronicotinate,abbypharma ap-30-7441,6-bromo-5-fluoropyridine-3-carboxylate,methyl 2-bromo-3-fluoro-5-pyridinecarboxylate,3-pyridinecarboxylic acid, 6-bromo-5-fluoro-, methyl ester |
| IUPAC Name | methyl 6-bromo-5-fluoropyridine-3-carboxylate |
| InChI Key | PXHKAVXJQLVUBI-UHFFFAOYSA-N |
| Molecular Formula | C7H5BrFNO2 |
2-[1-(tert-Butoxycarbonyl)piperid-4-yl]-1,3-thiazole-4-carboxylic acid, ≥95%, Thermo Scientific™
CAS: 668484-45-5 Molecular Formula: C13H19N3O4S Molecular Weight (g/mol): 313.372 MDL Number: MFCD06658980 InChI Key: FMSFMUBALWPCQM-UHFFFAOYSA-N Synonym: 2-4-tert-butoxycarbonyl piperazin-1-yl thiazole-4-carboxylic acid,2-4-tert-butoxycarbonyl piperazin-1-yl-1,3-thiazole-4-carboxylic acid PubChem CID: 59496772 IUPAC Name: 2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-1,3-thiazole-4-carboxylic acid SMILES: CC(C)(C)OC(=O)N1CCN(CC1)C2=NC(=CS2)C(=O)O
| PubChem CID | 59496772 |
|---|---|
| CAS | 668484-45-5 |
| Molecular Weight (g/mol) | 313.372 |
| MDL Number | MFCD06658980 |
| SMILES | CC(C)(C)OC(=O)N1CCN(CC1)C2=NC(=CS2)C(=O)O |
| Synonym | 2-4-tert-butoxycarbonyl piperazin-1-yl thiazole-4-carboxylic acid,2-4-tert-butoxycarbonyl piperazin-1-yl-1,3-thiazole-4-carboxylic acid |
| IUPAC Name | 2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-1,3-thiazole-4-carboxylic acid |
| InChI Key | FMSFMUBALWPCQM-UHFFFAOYSA-N |
| Molecular Formula | C13H19N3O4S |