Organoheterocyclic compounds
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2-Amino-4,6-dimethylpyrimidine, 98%
CAS: 767-15-7 Molecular Formula: C6H9N3 Molecular Weight (g/mol): 123.16 MDL Number: MFCD00006102 InChI Key: IDQNBVFPZMCDDN-UHFFFAOYSA-N Synonym: 2-amino-4,6-dimethylpyrimidine,acetylacetoneguanidine,2-pyrimidinamine, 4,6-dimethyl,4,6-dimethyl-2-pyrimidinamine,4,6-dimethylpyrimidin-2-ylamine,4,6-dimethyl-2-aminopyrimidine,pyrimidine, 2-amino-4,6-dimethyl,unii-4s48mi253m,2-amine-4,6-dimethylpyrimidine,2-amino-4,6-dimethyl pyrimidine PubChem CID: 13021 IUPAC Name: 4,6-dimethylpyrimidin-2-amine SMILES: CC1=CC(C)=NC(N)=N1
| PubChem CID | 13021 |
|---|---|
| CAS | 767-15-7 |
| Molecular Weight (g/mol) | 123.16 |
| MDL Number | MFCD00006102 |
| SMILES | CC1=CC(C)=NC(N)=N1 |
| Synonym | 2-amino-4,6-dimethylpyrimidine,acetylacetoneguanidine,2-pyrimidinamine, 4,6-dimethyl,4,6-dimethyl-2-pyrimidinamine,4,6-dimethylpyrimidin-2-ylamine,4,6-dimethyl-2-aminopyrimidine,pyrimidine, 2-amino-4,6-dimethyl,unii-4s48mi253m,2-amine-4,6-dimethylpyrimidine,2-amino-4,6-dimethyl pyrimidine |
| IUPAC Name | 4,6-dimethylpyrimidin-2-amine |
| InChI Key | IDQNBVFPZMCDDN-UHFFFAOYSA-N |
| Molecular Formula | C6H9N3 |
2-Methylfuran, 98+%, stab.
CAS: 534-22-5 Molecular Formula: C5H6O Molecular Weight (g/mol): 82.102 MDL Number: MFCD00003248 InChI Key: VQKFNUFAXTZWDK-UHFFFAOYSA-N Synonym: methylfuran,sylvan,2-methyl furan,silvan,furan, 2-methyl,5-methylfuran,alpha-methylfuran,furan, methyl,silvan czech,.alpha.-methylfuran PubChem CID: 10797 IUPAC Name: 2-methylfuran SMILES: CC1=CC=CO1
| PubChem CID | 10797 |
|---|---|
| CAS | 534-22-5 |
| Molecular Weight (g/mol) | 82.102 |
| MDL Number | MFCD00003248 |
| SMILES | CC1=CC=CO1 |
| Synonym | methylfuran,sylvan,2-methyl furan,silvan,furan, 2-methyl,5-methylfuran,alpha-methylfuran,furan, methyl,silvan czech,.alpha.-methylfuran |
| IUPAC Name | 2-methylfuran |
| InChI Key | VQKFNUFAXTZWDK-UHFFFAOYSA-N |
| Molecular Formula | C5H6O |
Oxidizing Reagent, 02M I2O in THF/Pyridine/Water, Novabiochem™, MilliporeSigma™
Molecular Formula: Mixture Synonym: DNA Reagent
| Synonym | DNA Reagent |
|---|---|
| Molecular Formula | Mixture |
5-Amino-3-methyl-1-phenylpyrazole, 97%
CAS: 1131-18-6 Molecular Formula: C10H11N3 Molecular Weight (g/mol): 173.21 InChI Key: FMKMKBLHMONXJM-UHFFFAOYSA-N Synonym: 3-methyl-1-phenyl-1h-pyrazol-5-amine,5-amino-3-methyl-1-phenylpyrazole,1h-pyrazol-5-amine, 3-methyl-1-phenyl,1-phenyl-3-methyl-5-aminopyrazole,3-methyl-1-phenylpyrazol-5-ylamine,5-methyl-2-phenyl-2h-pyrazol-3-ylamine,1-phenyl-3-methyl-5-amino pyrazole,unii-x6087geb2p,pyrazole, 5-amino-3-methyl-1-phenyl,1h-pyrazole-5-amine, 3-methyl-1-phenyl PubChem CID: 70801 IUPAC Name: 5-methyl-2-phenylpyrazol-3-amine SMILES: CC1=NN(C(=C1)N)C2=CC=CC=C2
| PubChem CID | 70801 |
|---|---|
| CAS | 1131-18-6 |
| Molecular Weight (g/mol) | 173.21 |
| SMILES | CC1=NN(C(=C1)N)C2=CC=CC=C2 |
| Synonym | 3-methyl-1-phenyl-1h-pyrazol-5-amine,5-amino-3-methyl-1-phenylpyrazole,1h-pyrazol-5-amine, 3-methyl-1-phenyl,1-phenyl-3-methyl-5-aminopyrazole,3-methyl-1-phenylpyrazol-5-ylamine,5-methyl-2-phenyl-2h-pyrazol-3-ylamine,1-phenyl-3-methyl-5-amino pyrazole,unii-x6087geb2p,pyrazole, 5-amino-3-methyl-1-phenyl,1h-pyrazole-5-amine, 3-methyl-1-phenyl |
| IUPAC Name | 5-methyl-2-phenylpyrazol-3-amine |
| InChI Key | FMKMKBLHMONXJM-UHFFFAOYSA-N |
| Molecular Formula | C10H11N3 |
5-Phenyltetrazole, 99%
CAS: 18039-42-4 Molecular Formula: C7H6N4 Molecular Weight (g/mol): 146.15 MDL Number: MFCD00022388 InChI Key: MARUHZGHZWCEQU-UHFFFAOYSA-N Synonym: 5-phenyl-1h-tetrazole,5-phenyltetrazole,1h-tetrazole, 5-phenyl,2h-tetrazole, 5-phenyl,phenyltetrazole,5-phenyl tetrazole,expandex 5pt,expandex ox 5pt,kempore 50xpt,5-phenyltetrazole van PubChem CID: 87425 IUPAC Name: 5-phenyl-2H-tetrazole SMILES: C1=CC=C(C=C1)C2=NNN=N2
| PubChem CID | 87425 |
|---|---|
| CAS | 18039-42-4 |
| Molecular Weight (g/mol) | 146.15 |
| MDL Number | MFCD00022388 |
| SMILES | C1=CC=C(C=C1)C2=NNN=N2 |
| Synonym | 5-phenyl-1h-tetrazole,5-phenyltetrazole,1h-tetrazole, 5-phenyl,2h-tetrazole, 5-phenyl,phenyltetrazole,5-phenyl tetrazole,expandex 5pt,expandex ox 5pt,kempore 50xpt,5-phenyltetrazole van |
| IUPAC Name | 5-phenyl-2H-tetrazole |
| InChI Key | MARUHZGHZWCEQU-UHFFFAOYSA-N |
| Molecular Formula | C7H6N4 |
Trimethylene sulfide
CAS: 287-27-4 Molecular Formula: C3H6S Molecular Weight (g/mol): 74.14 MDL Number: MFCD00042751 InChI Key: XSROQCDVUIHRSI-UHFFFAOYSA-N IUPAC Name: thietane SMILES: C1CSC1
| CAS | 287-27-4 |
|---|---|
| Molecular Weight (g/mol) | 74.14 |
| MDL Number | MFCD00042751 |
| SMILES | C1CSC1 |
| IUPAC Name | thietane |
| InChI Key | XSROQCDVUIHRSI-UHFFFAOYSA-N |
| Molecular Formula | C3H6S |
Piroxicam, USP, 97-103%, Spectrum™ Chemical
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CAS: 36322-90-4 Molecular Formula: C15H13N3O4S Molecular Weight (g/mol): 331.35 InChI Key: LDJVNWFKNMYYNT-FYWRMAATSA-N IUPAC Name: (3E)-3-{hydroxy[(pyridin-2-yl)amino]methylidene}-2-methyl-3,4-dihydro-2H-1λ6,2-benzothiazine-1,1,4-trione SMILES: CN1\C(=C(\O)NC2=CC=CC=N2)C(=O)C2=CC=CC=C2S1(=O)=O
| CAS | 36322-90-4 |
|---|---|
| Molecular Weight (g/mol) | 331.35 |
| SMILES | CN1\C(=C(\O)NC2=CC=CC=N2)C(=O)C2=CC=CC=C2S1(=O)=O |
| IUPAC Name | (3E)-3-{hydroxy[(pyridin-2-yl)amino]methylidene}-2-methyl-3,4-dihydro-2H-1λ6,2-benzothiazine-1,1,4-trione |
| InChI Key | LDJVNWFKNMYYNT-FYWRMAATSA-N |
| Molecular Formula | C15H13N3O4S |
7-Bromo-3,4-dihydro-2H-1,4-benzothiazine, 97%, Thermo Scientific Chemicals
CAS: 193414-60-7 Molecular Formula: C8H8BrNS Molecular Weight (g/mol): 230.12 MDL Number: MFCD11847754 InChI Key: QWWYGAWGUCQKDL-UHFFFAOYSA-N Synonym: 7-bromo-3,4-dihydro-2h-benzo b 1,4 thiazine PubChem CID: 83823811 IUPAC Name: 7-bromo-3,4-dihydro-2H-1,4-benzothiazine SMILES: BrC1=CC2=C(NCCS2)C=C1
| PubChem CID | 83823811 |
|---|---|
| CAS | 193414-60-7 |
| Molecular Weight (g/mol) | 230.12 |
| MDL Number | MFCD11847754 |
| SMILES | BrC1=CC2=C(NCCS2)C=C1 |
| Synonym | 7-bromo-3,4-dihydro-2h-benzo b 1,4 thiazine |
| IUPAC Name | 7-bromo-3,4-dihydro-2H-1,4-benzothiazine |
| InChI Key | QWWYGAWGUCQKDL-UHFFFAOYSA-N |
| Molecular Formula | C8H8BrNS |
Azure I
CAS: 531-55-5 Molecular Formula: C15H16ClN3S Molecular Weight (g/mol): 305.824 MDL Number: MFCD00011935 InChI Key: DNDJEIWCTMMZBX-UHFFFAOYSA-N Synonym: azure b,azure i,methylene azure b,3-dimethylamino-7-methylamino phenothiazin-5-ium chloride,trimethylthionine chloride,azur i,methyleneazure,methylene azure van,unii-7c8bel8wqv,modr kresylova bb czech PubChem CID: 68275 IUPAC Name: dimethyl-[7-(methylamino)phenothiazin-3-ylidene]azanium;chloride SMILES: CNC1=CC2=C(C=C1)N=C3C=CC(=[N+](C)C)C=C3S2.[Cl-]
| PubChem CID | 68275 |
|---|---|
| CAS | 531-55-5 |
| Molecular Weight (g/mol) | 305.824 |
| MDL Number | MFCD00011935 |
| SMILES | CNC1=CC2=C(C=C1)N=C3C=CC(=[N+](C)C)C=C3S2.[Cl-] |
| Synonym | azure b,azure i,methylene azure b,3-dimethylamino-7-methylamino phenothiazin-5-ium chloride,trimethylthionine chloride,azur i,methyleneazure,methylene azure van,unii-7c8bel8wqv,modr kresylova bb czech |
| IUPAC Name | dimethyl-[7-(methylamino)phenothiazin-3-ylidene]azanium;chloride |
| InChI Key | DNDJEIWCTMMZBX-UHFFFAOYSA-N |
| Molecular Formula | C15H16ClN3S |
6-Bromo-3,4-dihydro-2H-1,4-benzothiazine, 97%
CAS: 187604-75-7 Molecular Formula: C8H8BrNS Molecular Weight (g/mol): 230.123 MDL Number: MFCD23379863 InChI Key: AUIBYERXYVUBIL-UHFFFAOYSA-N Synonym: 6-bromo-3,4-dihydro-2h-benzo b 1,4 thiazine PubChem CID: 67172430 IUPAC Name: 6-bromo-3,4-dihydro-2H-1,4-benzothiazine SMILES: C1CSC2=C(N1)C=C(C=C2)Br
| PubChem CID | 67172430 |
|---|---|
| CAS | 187604-75-7 |
| Molecular Weight (g/mol) | 230.123 |
| MDL Number | MFCD23379863 |
| SMILES | C1CSC2=C(N1)C=C(C=C2)Br |
| Synonym | 6-bromo-3,4-dihydro-2h-benzo b 1,4 thiazine |
| IUPAC Name | 6-bromo-3,4-dihydro-2H-1,4-benzothiazine |
| InChI Key | AUIBYERXYVUBIL-UHFFFAOYSA-N |
| Molecular Formula | C8H8BrNS |
Methyl 3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxylate, 97%
CAS: 188614-01-9 Molecular Formula: C10H9NO3S Molecular Weight (g/mol): 223.25 MDL Number: MFCD00449104 InChI Key: UFSVRHNRNVVBJR-UHFFFAOYSA-N PubChem CID: 699501 IUPAC Name: methyl 3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxylate SMILES: COC(=O)C1=CC2=C(SCC(=O)N2)C=C1
| PubChem CID | 699501 |
|---|---|
| CAS | 188614-01-9 |
| Molecular Weight (g/mol) | 223.25 |
| MDL Number | MFCD00449104 |
| SMILES | COC(=O)C1=CC2=C(SCC(=O)N2)C=C1 |
| IUPAC Name | methyl 3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxylate |
| InChI Key | UFSVRHNRNVVBJR-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO3S |
Thiophene-3-carbonitrile, 98%
CAS: 1641-09-4 Molecular Formula: C5H3NS Molecular Weight (g/mol): 109.146 MDL Number: MFCD00151852 InChI Key: GSXCEVHRIVLFJV-UHFFFAOYSA-N Synonym: 3-cyanothiophene,3-thiophenecarbonitrile,thiophene-3-nitrile,pubchem5508,pubchem12351,acmc-209dqk,ksc176g4h PubChem CID: 74231 IUPAC Name: thiophene-3-carbonitrile SMILES: C1=CSC=C1C#N
| PubChem CID | 74231 |
|---|---|
| CAS | 1641-09-4 |
| Molecular Weight (g/mol) | 109.146 |
| MDL Number | MFCD00151852 |
| SMILES | C1=CSC=C1C#N |
| Synonym | 3-cyanothiophene,3-thiophenecarbonitrile,thiophene-3-nitrile,pubchem5508,pubchem12351,acmc-209dqk,ksc176g4h |
| IUPAC Name | thiophene-3-carbonitrile |
| InChI Key | GSXCEVHRIVLFJV-UHFFFAOYSA-N |
| Molecular Formula | C5H3NS |
3-(2-Furyl)propanoic acid, 98%
CAS: 935-13-7 Molecular Formula: C7H8O3 Molecular Weight (g/mol): 140.14 InChI Key: XLTJXJJMUFDQEZ-UHFFFAOYSA-N Synonym: 3-furan-2-yl propanoic acid,3-2-furyl propanoic acid,2-furanpropanoic acid,2-furanpropionic acid,3-2-furyl propionic acid,3-furan-2-yl-propionic acid,furan-2-propionic acid,3-2-furyl propoinic acid,furfuryl-essigsaure,furfurylacetic acid PubChem CID: 70286 IUPAC Name: 3-(furan-2-yl)propanoic acid SMILES: C1=COC(=C1)CCC(=O)O
| PubChem CID | 70286 |
|---|---|
| CAS | 935-13-7 |
| Molecular Weight (g/mol) | 140.14 |
| SMILES | C1=COC(=C1)CCC(=O)O |
| Synonym | 3-furan-2-yl propanoic acid,3-2-furyl propanoic acid,2-furanpropanoic acid,2-furanpropionic acid,3-2-furyl propionic acid,3-furan-2-yl-propionic acid,furan-2-propionic acid,3-2-furyl propoinic acid,furfuryl-essigsaure,furfurylacetic acid |
| IUPAC Name | 3-(furan-2-yl)propanoic acid |
| InChI Key | XLTJXJJMUFDQEZ-UHFFFAOYSA-N |
| Molecular Formula | C7H8O3 |
2-(4-Pyridyl)benzimidazole, 97%
CAS: 2208-59-5 Molecular Formula: C12H9N3 Molecular Weight (g/mol): 195.23 MDL Number: MFCD00453948 InChI Key: UYWWLYCGNNCLKE-UHFFFAOYSA-N Synonym: 2-4-pyridyl benzimidazole,2-pyridin-4-yl-1h-benzo d imidazole,2-pyridin-4-yl-1h-benzimidazole,2-pyridin-4-yl-1h-1,3-benzodiazole,2-4-pyridyl-1h-benzimidazole,2-pyridin-4-yl-1h-benzoimidazole,2-benzimidazole,acmc-1ch3h,cambridge id 5231114,2-4-pyridinyl-benzimidazole PubChem CID: 247634 IUPAC Name: 2-pyridin-4-yl-1H-benzimidazole SMILES: N1C2=CC=CC=C2N=C1C1=CC=NC=C1
| PubChem CID | 247634 |
|---|---|
| CAS | 2208-59-5 |
| Molecular Weight (g/mol) | 195.23 |
| MDL Number | MFCD00453948 |
| SMILES | N1C2=CC=CC=C2N=C1C1=CC=NC=C1 |
| Synonym | 2-4-pyridyl benzimidazole,2-pyridin-4-yl-1h-benzo d imidazole,2-pyridin-4-yl-1h-benzimidazole,2-pyridin-4-yl-1h-1,3-benzodiazole,2-4-pyridyl-1h-benzimidazole,2-pyridin-4-yl-1h-benzoimidazole,2-benzimidazole,acmc-1ch3h,cambridge id 5231114,2-4-pyridinyl-benzimidazole |
| IUPAC Name | 2-pyridin-4-yl-1H-benzimidazole |
| InChI Key | UYWWLYCGNNCLKE-UHFFFAOYSA-N |
| Molecular Formula | C12H9N3 |
4-Pyridineacetonitrile, ≥97%, Thermo Scientific Chemicals
CAS: 13121-99-8 Molecular Formula: C7H6N2 Molecular Weight (g/mol): 118.14 MDL Number: MFCD03412601 InChI Key: BMVSAKPRNWZCPG-UHFFFAOYSA-N Synonym: pyridin-4-yl-acetonitrile,2-pyridin-4-yl acetonitrile,4-pyridylacetonitrile,4-pyridineacetonitrile,pyridin-4-ylacetonitrile,pyridine-4-acetonitrile,rarechem ak ml 0204,2-4-pyridyl acetonitrile,4-pyridylacetonitrilehydrochloride,4-cyanomethyl-pyridine PubChem CID: 4112085 IUPAC Name: 2-pyridin-4-ylacetonitrile SMILES: N#CCC1=CC=NC=C1
| PubChem CID | 4112085 |
|---|---|
| CAS | 13121-99-8 |
| Molecular Weight (g/mol) | 118.14 |
| MDL Number | MFCD03412601 |
| SMILES | N#CCC1=CC=NC=C1 |
| Synonym | pyridin-4-yl-acetonitrile,2-pyridin-4-yl acetonitrile,4-pyridylacetonitrile,4-pyridineacetonitrile,pyridin-4-ylacetonitrile,pyridine-4-acetonitrile,rarechem ak ml 0204,2-4-pyridyl acetonitrile,4-pyridylacetonitrilehydrochloride,4-cyanomethyl-pyridine |
| IUPAC Name | 2-pyridin-4-ylacetonitrile |
| InChI Key | BMVSAKPRNWZCPG-UHFFFAOYSA-N |
| Molecular Formula | C7H6N2 |