Vitas-M small molecule compound
2-({2-[(2,5-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)pyridine-3-carboxylic acid
Catalog ID
STK922381
SMILES O=C(Nc1cc(C)ccc1C)CSc1ncccc1C(=O)O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C16H16N2O3S MW 316.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O3S/c1-10-5-6-11(2)13(8-10)18-14(19)9-22-15-12(16(20)21)4-3-7-17-15/h3-8H,9H2,1-2H3,(H,18,19)(H,20,21)InChIKey
RLDOUQCKWUTHTQ-UHFFFAOYSA-NSynonyms
460736-19-02((2((25dimethylphenyl)amino)2oxoethyl)sulfanyl)pyridine3carboxylicacid
2((2((25DIMETHYLPHENYL)AMINO)2OXOETHYL)THIO)NICOTINICACID
2((25DIMETHYLPHENYLCARBAMOYL)METHYLSULFANYL)NICOTINICACID
2((N(25DIMETHYLPHENYL)CARBAMOYL)METHYLTHIO)PYRIDINE3CARBOXYLICACID
2(2(25DIMETHYLANILINO)2OXOETHYL)SULFANYLPYRIDINE3CARBOXYLICACID
460736190
CC1=CC(=C(C=C1)C)NC(=O)CSC2=C(C=CC=N2)C(=O)O
InChI=1SC16H16N2O3Sc1105611(2)13(810)1814(19)9221512(16(20)21)4371715h38H9H212H3(H1819)(H2021)
MFCD03123075
ZINC000004213084
ZINC4213084
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