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Vitas-M small molecule compound

ethyl 6-({2-[(4-acetylphenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-2-hydroxypyridine-3-carboxylate

Catalog ID
STK054047
SMILES CCOC(=O)c1cc(C#N)c(nc1O)SCC(=O)Nc1ccc(cc1)C(=O)C

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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 C19H17N3O5S MW 399.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N3O5S/c1-3-27-19(26)15-8-13(9-20)18(22-17(15)25)28-10-16(24)21-14-6-4-12(5-7-14)11(2)23/h4-8H,3,10H2,1-2H3,(H,21,24)(H,22,25)
InChIKey
FNZWPOYLFOLJND-UHFFFAOYSA-N
Synonyms
380327-79-7
6((4ACETYLPHENYLCARBAMOYL)METHYLSULFANYL)5CYANO2HYDROXYNICOTINICACIDETHYLESTER
CCOC(=O)C1=CC(=C(NC1=O)SCC(=O)NC2=CC=C(C=C2)C(=O)C)C#N
CCOC(=O)c1cc(C#N)c(nc1O)SCC(=O)Nc1ccc(cc1)C(=O)C
ETHYL6((2((4ACETYLPHENYL)AMINO)2OXOETHYL)SULFANYL)5CYANO2HYDROXYNICOTINATE
ETHYL6((2((4ACETYLPHENYL)AMINO)2OXOETHYL)SULFANYL)5CYANO2HYDROXYPYRIDINE3CARBOXYLATE
ETHYL6((2((4ACETYLPHENYL)AMINO)2OXOETHYL)SULFANYL)5CYANO2OXO12DIHYDROPYRIDINE3CARBOXYLATE
ETHYL6((2((4ACETYLPHENYL)AMINO)2OXOETHYL)THIO)5CYANO2HYDROXYNICOTINATE
ETHYL6((2(4ACETYLANILINO)2OXOETHYL)SULFANYL)5CYANO2HYDROXYNICOTINATE
ETHYL6((N(4ACETYLPHENYL)CARBAMOYL)METHYLTHIO)5CYANO2HYDROXYPYRIDINE3CARBOXYLATE
ETHYL6(2(4ACETYLANILINO)2OXOETHYL)SULFANYL5CYANO2OXO1HPYRIDINE3CARBOXYLATE
InChI=1SC19H17N3O5Sc132719(26)15813(920)18(2217(15)25)281016(24)21146412(5714)11(2)23h48H310H212H3(H2124)(H2225)
MFCD03032348
STK054047
ZINC000008856136
ZINC8856136

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Available files

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