Organoheterocyclic compounds
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Methyl 2-bromothiazole-4-carboxylate, 96%, Thermo Scientific Chemicals
CAS: 170235-26-4 Molecular Formula: C5H4BrNO2S Molecular Weight (g/mol): 222.056 MDL Number: MFCD06659908 InChI Key: YOWKNNKTQWCYNC-UHFFFAOYSA-N PubChem CID: 2763213 IUPAC Name: methyl 2-bromo-1,3-thiazole-4-carboxylate SMILES: COC(=O)C1=CSC(=N1)Br
| PubChem CID | 2763213 |
|---|---|
| CAS | 170235-26-4 |
| Molecular Weight (g/mol) | 222.056 |
| MDL Number | MFCD06659908 |
| SMILES | COC(=O)C1=CSC(=N1)Br |
| IUPAC Name | methyl 2-bromo-1,3-thiazole-4-carboxylate |
| InChI Key | YOWKNNKTQWCYNC-UHFFFAOYSA-N |
| Molecular Formula | C5H4BrNO2S |
4-Methyl-2-phenyl-1,3-thiazole-5-sulfonyl chloride, Technical, Thermo Scientific™
CAS: 690632-88-3 Molecular Formula: C10H8ClNO2S2 Molecular Weight (g/mol): 273.749 InChI Key: NGDQQLAVJWUYSF-UHFFFAOYSA-N Synonym: 4-methyl-2-phenylthiazole-5-sulfonyl chloride,4-methyl-2-phenyl-thiazole-5-sulfonyl chloride,5-thiazolesulfonyl chloride, 4-methyl-2-phenyl,4-methyl-2-phenyl-1,3-thiazole-5-sulfonylchloride PubChem CID: 2795490 IUPAC Name: 4-methyl-2-phenyl-1,3-thiazole-5-sulfonyl chloride SMILES: CC1=C(SC(=N1)C2=CC=CC=C2)S(=O)(=O)Cl
| PubChem CID | 2795490 |
|---|---|
| CAS | 690632-88-3 |
| Molecular Weight (g/mol) | 273.749 |
| SMILES | CC1=C(SC(=N1)C2=CC=CC=C2)S(=O)(=O)Cl |
| Synonym | 4-methyl-2-phenylthiazole-5-sulfonyl chloride,4-methyl-2-phenyl-thiazole-5-sulfonyl chloride,5-thiazolesulfonyl chloride, 4-methyl-2-phenyl,4-methyl-2-phenyl-1,3-thiazole-5-sulfonylchloride |
| IUPAC Name | 4-methyl-2-phenyl-1,3-thiazole-5-sulfonyl chloride |
| InChI Key | NGDQQLAVJWUYSF-UHFFFAOYSA-N |
| Molecular Formula | C10H8ClNO2S2 |
Ethyl 2-bromothiazole-4-carboxylate, 96%
CAS: 100367-77-9 Molecular Formula: C6H6BrNO2S Molecular Weight (g/mol): 236.09 InChI Key: CNHISCQPKKGDPO-UHFFFAOYSA-N Synonym: ethyl 2-bromothiazole-4-carboxylate,2-bromothiazole-4-carboxylic acid ethyl ester,4-thiazolecarboxylic acid, 2-bromo-, ethyl ester,ethyl2-bromothiazole-4-carboxylate,ethyl 2-bromo-4-thiazolecarboxylate,2-bromo-thiazole-4-carboxylic acid ethyl ester,2-bromo-4-ethoxycarbonyl-1,3-thiazole,2-bromo-1,3-thiazole-4-carboxylic acid ethyl ester,zlchem 490,pubchem17466 PubChem CID: 353965 IUPAC Name: ethyl 2-bromo-1,3-thiazole-4-carboxylate SMILES: CCOC(=O)C1=CSC(=N1)Br
| PubChem CID | 353965 |
|---|---|
| CAS | 100367-77-9 |
| Molecular Weight (g/mol) | 236.09 |
| SMILES | CCOC(=O)C1=CSC(=N1)Br |
| Synonym | ethyl 2-bromothiazole-4-carboxylate,2-bromothiazole-4-carboxylic acid ethyl ester,4-thiazolecarboxylic acid, 2-bromo-, ethyl ester,ethyl2-bromothiazole-4-carboxylate,ethyl 2-bromo-4-thiazolecarboxylate,2-bromo-thiazole-4-carboxylic acid ethyl ester,2-bromo-4-ethoxycarbonyl-1,3-thiazole,2-bromo-1,3-thiazole-4-carboxylic acid ethyl ester,zlchem 490,pubchem17466 |
| IUPAC Name | ethyl 2-bromo-1,3-thiazole-4-carboxylate |
| InChI Key | CNHISCQPKKGDPO-UHFFFAOYSA-N |
| Molecular Formula | C6H6BrNO2S |
4-(Chloromethyl)-2-methyl-1,3-thiazole hydrochloride , Tech., Thermo Scientific™
CAS: 77470-53-2 Molecular Formula: C5H7Cl2NS Molecular Weight (g/mol): 184.08 MDL Number: MFCD00067725 InChI Key: YGKDISJLDVGNOR-UHFFFAOYSA-N Synonym: 4-chloromethyl-2-methylthiazole hydrochloride,4-chloromethyl-2-methyl-1,3-thiazole hydrochloride,4-chloromethyl-2-methylthiazole hcl,4-chloromethyl-2-methyl thiazole hydrochloride,2-methyl-4-chloromethyl thiazole hydrochloride,4-chloromethyl-2-methyl-1,3-thiazole, chloride,2-methyl-4-chloromethylthiazole hydrochloride,4-chloromethyl-2-methyl-1,3-thiazole hcl PubChem CID: 2734203 IUPAC Name: 4-(chloromethyl)-2-methyl-1,3-thiazole;hydrochloride SMILES: Cl.CC1=NC(CCl)=CS1
| PubChem CID | 2734203 |
|---|---|
| CAS | 77470-53-2 |
| Molecular Weight (g/mol) | 184.08 |
| MDL Number | MFCD00067725 |
| SMILES | Cl.CC1=NC(CCl)=CS1 |
| Synonym | 4-chloromethyl-2-methylthiazole hydrochloride,4-chloromethyl-2-methyl-1,3-thiazole hydrochloride,4-chloromethyl-2-methylthiazole hcl,4-chloromethyl-2-methyl thiazole hydrochloride,2-methyl-4-chloromethyl thiazole hydrochloride,4-chloromethyl-2-methyl-1,3-thiazole, chloride,2-methyl-4-chloromethylthiazole hydrochloride,4-chloromethyl-2-methyl-1,3-thiazole hcl |
| IUPAC Name | 4-(chloromethyl)-2-methyl-1,3-thiazole;hydrochloride |
| InChI Key | YGKDISJLDVGNOR-UHFFFAOYSA-N |
| Molecular Formula | C5H7Cl2NS |
2-(3-Chlorophenyl)-1,3-thiazole-4-carbaldehyde, 97%, Thermo Scientific™
CAS: 859850-99-0 Molecular Formula: C10H6ClNOS Molecular Weight (g/mol): 223.67 MDL Number: MFCD06738360 InChI Key: XMXWYXGIKFBCGR-UHFFFAOYSA-N Synonym: 2-3-chlorophenyl thiazole-4-carbaldehyde,2-3-chlorophenyl-1,3-thiazole-4-carbaldehyde,2-3-chloro-phenyl-thiazole-4-carbaldehyde,4-thiazolecarboxaldehyde,2-3-chlorophenyl,2-3-chlorophenyl-1,3-thiazole-4-carboxaldehyde 97,2-3-chlorophenyl-1,3-thiazole-4-carboxaldehyde PubChem CID: 18525798 IUPAC Name: 2-(3-chlorophenyl)-1,3-thiazole-4-carbaldehyde SMILES: ClC1=CC=CC(=C1)C1=NC(C=O)=CS1
| PubChem CID | 18525798 |
|---|---|
| CAS | 859850-99-0 |
| Molecular Weight (g/mol) | 223.67 |
| MDL Number | MFCD06738360 |
| SMILES | ClC1=CC=CC(=C1)C1=NC(C=O)=CS1 |
| Synonym | 2-3-chlorophenyl thiazole-4-carbaldehyde,2-3-chlorophenyl-1,3-thiazole-4-carbaldehyde,2-3-chloro-phenyl-thiazole-4-carbaldehyde,4-thiazolecarboxaldehyde,2-3-chlorophenyl,2-3-chlorophenyl-1,3-thiazole-4-carboxaldehyde 97,2-3-chlorophenyl-1,3-thiazole-4-carboxaldehyde |
| IUPAC Name | 2-(3-chlorophenyl)-1,3-thiazole-4-carbaldehyde |
| InChI Key | XMXWYXGIKFBCGR-UHFFFAOYSA-N |
| Molecular Formula | C10H6ClNOS |
2-(4-Methyl-5-thiazolyl)ethyl acetate, 98+%
CAS: 656-53-1 Molecular Formula: C8H11NO2S Molecular Weight (g/mol): 185.24 MDL Number: MFCD00005338 InChI Key: CRTCWNPLKVVXIX-UHFFFAOYSA-N Synonym: 2-4-methylthiazol-5-yl ethyl acetate,4-methyl-5-thiazolylethyl acetate,2-4-methyl-5-thiazolyl ethyl acetate,sulfurol acetate,4-methyl-5-2-acetoxyethyl thiazole,4-methyl-5-thiazoleethanol acetate,5-2-acetoxyethyl-4-methylthiazole,2-4-methyl-1,3-thiazol-5-yl ethyl acetate,5-thiazoleethanol, 4-methyl-, acetate ester,4-methyl-5-beta-acetoxyethyl thiazole PubChem CID: 61192 IUPAC Name: 2-(4-methyl-1,3-thiazol-5-yl)ethyl acetate SMILES: CC(=O)OCCC1=C(C)N=CS1
| PubChem CID | 61192 |
|---|---|
| CAS | 656-53-1 |
| Molecular Weight (g/mol) | 185.24 |
| MDL Number | MFCD00005338 |
| SMILES | CC(=O)OCCC1=C(C)N=CS1 |
| Synonym | 2-4-methylthiazol-5-yl ethyl acetate,4-methyl-5-thiazolylethyl acetate,2-4-methyl-5-thiazolyl ethyl acetate,sulfurol acetate,4-methyl-5-2-acetoxyethyl thiazole,4-methyl-5-thiazoleethanol acetate,5-2-acetoxyethyl-4-methylthiazole,2-4-methyl-1,3-thiazol-5-yl ethyl acetate,5-thiazoleethanol, 4-methyl-, acetate ester,4-methyl-5-beta-acetoxyethyl thiazole |
| IUPAC Name | 2-(4-methyl-1,3-thiazol-5-yl)ethyl acetate |
| InChI Key | CRTCWNPLKVVXIX-UHFFFAOYSA-N |
| Molecular Formula | C8H11NO2S |
Ethyl 5-amino-3-methylisothiazole-4-carboxylate, 97%, Thermo Scientific™
CAS: 34859-65-9 Molecular Formula: C7H10N2O2S Molecular Weight (g/mol): 186.229 InChI Key: ZDGBWOZFPKNORL-UHFFFAOYSA-N PubChem CID: 2820511 IUPAC Name: ethyl 5-amino-3-methyl-1,2-thiazole-4-carboxylate SMILES: CCOC(=O)C1=C(SN=C1C)N
| PubChem CID | 2820511 |
|---|---|
| CAS | 34859-65-9 |
| Molecular Weight (g/mol) | 186.229 |
| SMILES | CCOC(=O)C1=C(SN=C1C)N |
| IUPAC Name | ethyl 5-amino-3-methyl-1,2-thiazole-4-carboxylate |
| InChI Key | ZDGBWOZFPKNORL-UHFFFAOYSA-N |
| Molecular Formula | C7H10N2O2S |
Adenine Hemisulfate Dihydrate MP Biomedicals
CAS: 6509-19-9 Molecular Formula: C10H16N10O6S Molecular Weight (g/mol): 404.36 MDL Number: MFCD00150149 InChI Key: MKPCNMXYTMQZBE-UHFFFAOYSA-N Synonym: 9h-purin-6-amine hemisulfate dihydrate,adenine hemisulfate dihydrate,6-aminopurine sulfate dihydrate,bis ade sulfuric acid dihydrate,sulfuric acid bis vitamin b4 dihydrate,bis adenine sulfuric acid dihydrate,sulfuric acid-7h-purin-6-amine-water 1/2/2 PubChem CID: 44134512 IUPAC Name: bis(7H-purin-6-amine) sulfuric acid dihydrate SMILES: O.O.OS(O)(=O)=O.NC1=C2NC=NC2=NC=N1.NC1=C2NC=NC2=NC=N1
| PubChem CID | 44134512 |
|---|---|
| CAS | 6509-19-9 |
| Molecular Weight (g/mol) | 404.36 |
| MDL Number | MFCD00150149 |
| SMILES | O.O.OS(O)(=O)=O.NC1=C2NC=NC2=NC=N1.NC1=C2NC=NC2=NC=N1 |
| Synonym | 9h-purin-6-amine hemisulfate dihydrate,adenine hemisulfate dihydrate,6-aminopurine sulfate dihydrate,bis ade sulfuric acid dihydrate,sulfuric acid bis vitamin b4 dihydrate,bis adenine sulfuric acid dihydrate,sulfuric acid-7h-purin-6-amine-water 1/2/2 |
| IUPAC Name | bis(7H-purin-6-amine) sulfuric acid dihydrate |
| InChI Key | MKPCNMXYTMQZBE-UHFFFAOYSA-N |
| Molecular Formula | C10H16N10O6S |
Imidazole, MP Biomedicals™
CAS: 288-32-4 Molecular Formula: C3H4N2 Molecular Weight (g/mol): 68.08 MDL Number: MFCD00005183 InChI Key: RAXXELZNTBOGNW-UHFFFAOYSA-N Synonym: imidazole,glyoxaline,imidazol,iminazole,miazole,1,3-diazole,glyoxalin,imutex,1,3-diaza-2,4-cyclopentadiene,pyrro b monazole PubChem CID: 795 ChEBI: CHEBI:16069 IUPAC Name: 1H-imidazole SMILES: N1C=CN=C1
| PubChem CID | 795 |
|---|---|
| CAS | 288-32-4 |
| Molecular Weight (g/mol) | 68.08 |
| ChEBI | CHEBI:16069 |
| MDL Number | MFCD00005183 |
| SMILES | N1C=CN=C1 |
| Synonym | imidazole,glyoxaline,imidazol,iminazole,miazole,1,3-diazole,glyoxalin,imutex,1,3-diaza-2,4-cyclopentadiene,pyrro b monazole |
| IUPAC Name | 1H-imidazole |
| InChI Key | RAXXELZNTBOGNW-UHFFFAOYSA-N |
| Molecular Formula | C3H4N2 |
D-Biotin, MP Biomedicals™
CAS: 58-85-5 Molecular Formula: C10H16N2O3S Molecular Weight (g/mol): 244.31 MDL Number: MFCD00005541 InChI Key: YBJHBAHKTGYVGT-UHFFFAOYNA-N Synonym: biotin,d-biotin,vitamin h,coenzyme r,vitamin b7,bios ii,factor s,bioepiderm,d +-biotin,biodermatin PubChem CID: 171548 ChEBI: CHEBI:15956 IUPAC Name: 5-{2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl}pentanoic acid SMILES: OC(=O)CCCCC1SCC2NC(=O)NC12
| PubChem CID | 171548 |
|---|---|
| CAS | 58-85-5 |
| Molecular Weight (g/mol) | 244.31 |
| ChEBI | CHEBI:15956 |
| MDL Number | MFCD00005541 |
| SMILES | OC(=O)CCCCC1SCC2NC(=O)NC12 |
| Synonym | biotin,d-biotin,vitamin h,coenzyme r,vitamin b7,bios ii,factor s,bioepiderm,d +-biotin,biodermatin |
| IUPAC Name | 5-{2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl}pentanoic acid |
| InChI Key | YBJHBAHKTGYVGT-UHFFFAOYNA-N |
| Molecular Formula | C10H16N2O3S |
Ethyl (R)-nipecotate L-tartrate, 98%, Thermo Scientific Chemicals
CAS: 167392-57-6 Molecular Formula: C12H21NO8 Molecular Weight (g/mol): 307.299 MDL Number: MFCD00799538 InChI Key: HHPGQKZOPPDLNH-RATVZYDNSA-N Synonym: s,s-tartaric acid; ethyl 3r-piperidine-3-carboxylate,3s-2,3-bis oxidanyl butanedioic acid; ethyl 3r-piperidine-3-carboxylate,3s-2,3-dihydroxybutanedioic acid; 3r-3-piperidinecarboxylic acid ethyl ester PubChem CID: 53249980 IUPAC Name: (3S)-2,3-dihydroxybutanedioic acid;ethyl (3R)-piperidine-3-carboxylate SMILES: CCOC(=O)C1CCCNC1.C(C(C(=O)O)O)(C(=O)O)O
| PubChem CID | 53249980 |
|---|---|
| CAS | 167392-57-6 |
| Molecular Weight (g/mol) | 307.299 |
| MDL Number | MFCD00799538 |
| SMILES | CCOC(=O)C1CCCNC1.C(C(C(=O)O)O)(C(=O)O)O |
| Synonym | s,s-tartaric acid; ethyl 3r-piperidine-3-carboxylate,3s-2,3-bis oxidanyl butanedioic acid; ethyl 3r-piperidine-3-carboxylate,3s-2,3-dihydroxybutanedioic acid; 3r-3-piperidinecarboxylic acid ethyl ester |
| IUPAC Name | (3S)-2,3-dihydroxybutanedioic acid;ethyl (3R)-piperidine-3-carboxylate |
| InChI Key | HHPGQKZOPPDLNH-RATVZYDNSA-N |
| Molecular Formula | C12H21NO8 |
4-Piperidinobenzoic acid, 97%, Thermo Scientific™
CAS: 22090-24-0 Molecular Formula: C12H14NO2 Molecular Weight (g/mol): 204.25 MDL Number: MFCD00587602 InChI Key: DGJNUESQBVPXAY-UHFFFAOYSA-M PubChem CID: 764599 IUPAC Name: 4-piperidin-1-ylbenzoic acid SMILES: [O-]C(=O)C1=CC=C(C=C1)N1CCCCC1
| PubChem CID | 764599 |
|---|---|
| CAS | 22090-24-0 |
| Molecular Weight (g/mol) | 204.25 |
| MDL Number | MFCD00587602 |
| SMILES | [O-]C(=O)C1=CC=C(C=C1)N1CCCCC1 |
| IUPAC Name | 4-piperidin-1-ylbenzoic acid |
| InChI Key | DGJNUESQBVPXAY-UHFFFAOYSA-M |
| Molecular Formula | C12H14NO2 |
(+/-)-1-Boc-3-(hydroxymethyl)piperidine, 97%
CAS: 116574-71-1 Molecular Formula: C11H21NO3 Molecular Weight (g/mol): 215.293 MDL Number: MFCD03094733 InChI Key: OJCLHERKFHHUTB-UHFFFAOYSA-N Synonym: n-boc-piperidine-3-methanol,tert-butyl 3-hydroxymethyl piperidine-1-carboxylate,1-boc-3-piperidinemethanol,n-boc-3-piperidinemethanol,3-hydroxymethyl-1-n-boc-piperidine,n-boc-3-hydroxymethylpiperidine,1-boc-3-hydroxymethylpiperidine,1-boc-3-hydroxymethyl piperidine,tert-butyl 3-hydroxymethyl tetrahydro-1 2h-pyridinecarboxylate,+/--n-boc-3-piperidine methanol PubChem CID: 2763851 IUPAC Name: tert-butyl 3-(hydroxymethyl)piperidine-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CCCC(C1)CO
| PubChem CID | 2763851 |
|---|---|
| CAS | 116574-71-1 |
| Molecular Weight (g/mol) | 215.293 |
| MDL Number | MFCD03094733 |
| SMILES | CC(C)(C)OC(=O)N1CCCC(C1)CO |
| Synonym | n-boc-piperidine-3-methanol,tert-butyl 3-hydroxymethyl piperidine-1-carboxylate,1-boc-3-piperidinemethanol,n-boc-3-piperidinemethanol,3-hydroxymethyl-1-n-boc-piperidine,n-boc-3-hydroxymethylpiperidine,1-boc-3-hydroxymethylpiperidine,1-boc-3-hydroxymethyl piperidine,tert-butyl 3-hydroxymethyl tetrahydro-1 2h-pyridinecarboxylate,+/--n-boc-3-piperidine methanol |
| IUPAC Name | tert-butyl 3-(hydroxymethyl)piperidine-1-carboxylate |
| InChI Key | OJCLHERKFHHUTB-UHFFFAOYSA-N |
| Molecular Formula | C11H21NO3 |
Ethyl 1-(6-methylpyrazin-2-yl)piperidine-3-carboxylate, 97%, Thermo Scientific™
CAS: 926921-61-1 Molecular Formula: C13H19N3O2 Molecular Weight (g/mol): 249.31 MDL Number: MFCD09817500 InChI Key: MTWGDARCNWTWJN-UHFFFAOYNA-N Synonym: ethyl 1-6-methylpyrazin-2-yl piperidine-3-carboxylate PubChem CID: 24229600 IUPAC Name: ethyl 1-(6-methylpyrazin-2-yl)piperidine-3-carboxylate SMILES: CCOC(=O)C1CCCN(C1)C1=NC(C)=CN=C1
| PubChem CID | 24229600 |
|---|---|
| CAS | 926921-61-1 |
| Molecular Weight (g/mol) | 249.31 |
| MDL Number | MFCD09817500 |
| SMILES | CCOC(=O)C1CCCN(C1)C1=NC(C)=CN=C1 |
| Synonym | ethyl 1-6-methylpyrazin-2-yl piperidine-3-carboxylate |
| IUPAC Name | ethyl 1-(6-methylpyrazin-2-yl)piperidine-3-carboxylate |
| InChI Key | MTWGDARCNWTWJN-UHFFFAOYNA-N |
| Molecular Formula | C13H19N3O2 |
3-Aminopiperidine dihydrochloride, 97%
CAS: 138060-07-8 Molecular Formula: C5H12N2·2HCl Molecular Weight (g/mol): 173.09 MDL Number: MFCD00012773 InChI Key: GGPNYXIOFZLNKW-UHFFFAOYSA-N Synonym: 3-aminopiperidine dihydrochloride,piperidin-3-amine dihydrochloride,3-aminopiperidine 2hcl,3-aminopiperidine hcl,3-piperidinamine dihydrochloride,3-piperidinamine, dihydrochloride,pubchem6755,acmc-209tvl,ksc839o8j,3-amino-piperidine di-hydrochloride PubChem CID: 16211870 IUPAC Name: piperidin-3-amine;dihydrochloride SMILES: C1CC(CNC1)N.Cl.Cl
| PubChem CID | 16211870 |
|---|---|
| CAS | 138060-07-8 |
| Molecular Weight (g/mol) | 173.09 |
| MDL Number | MFCD00012773 |
| SMILES | C1CC(CNC1)N.Cl.Cl |
| Synonym | 3-aminopiperidine dihydrochloride,piperidin-3-amine dihydrochloride,3-aminopiperidine 2hcl,3-aminopiperidine hcl,3-piperidinamine dihydrochloride,3-piperidinamine, dihydrochloride,pubchem6755,acmc-209tvl,ksc839o8j,3-amino-piperidine di-hydrochloride |
| IUPAC Name | piperidin-3-amine;dihydrochloride |
| InChI Key | GGPNYXIOFZLNKW-UHFFFAOYSA-N |
| Molecular Formula | C5H12N2·2HCl |