Vitas-M small molecule compound
methyl {[4-(2-chlorophenyl)-3-cyano-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetate
Catalog ID
STK009634
SMILES COC(=O)CSC1=C(C#N)C(CC(=O)N1)c1ccccc1Cl
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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 C15H13ClN2O3S MW 336.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13ClN2O3S/c1-21-14(20)8-22-15-11(7-17)10(6-13(19)18-15)9-4-2-3-5-12(9)16/h2-5,10H,6,8H2,1H3,(H,18,19)InChIKey
ZBCFBPYJRHOKAV-UHFFFAOYSA-NSynonyms
325725-48-2COC(=O)CSC1=C(C#N)C(CC(=O)N1)c1ccccc1Cl
COC(=O)CSC1=C(C(CC(=O)N1)C2=CC=CC=C2Cl)C#N
InChI=1SC15H13ClN2O3Sc12114(20)8221511(717)10(613(19)1815)9423512(9)16h2510H68H21H3(H1819)
METHYL((4(2CHLOROPHENYL)3CYANO6HYDROXY45DIHYDROPYRIDIN2YL)SULFANYL)ACETATE
methyl((4(2chlorophenyl)3cyano6oxo1456tetrahydropyridin2yl)sulfanyl)acetate
methyl2((4(2chlorophenyl)3cyano6oxo1456tetrahydropyridin2yl)thio)acetate
METHYL2((4(2CHLOROPHENYL)5CYANO2OXO34DIHYDRO1HPYRIDIN6YL)SULFANYL)ACETATE
MFCD00405361
STK009634
ZINC000008973095
ZINC000008973096
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