Vitas-M small molecule compound
methyl 6-(benzylsulfanyl)-4-(4-chlorophenyl)-5-cyano-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Catalog ID
STK699413
SMILES COC(=O)C1C(=O)NC(=C(C1c1ccc(cc1)Cl)C#N)SCc1ccccc1
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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 C21H17ClN2O3S MW 412.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN2O3S/c1-27-21(26)18-17(14-7-9-15(22)10-8-14)16(11-23)20(24-19(18)25)28-12-13-5-3-2-4-6-13/h2-10,17-18H,12H2,1H3,(H,24,25)InChIKey
PCXNPDWNDGLJRJ-UHFFFAOYSA-NSynonyms
361478-15-1361478151
COC(=O)C1C(C(=C(NC1=O)SCC2=CC=CC=C2)C#N)C3=CC=C(C=C3)Cl
InChI=1SC21H17ClN2O3Sc12721(26)1817(147915(22)10814)16(1123)20(2419(18)25)2812135324613h2101718H12H21H3(H2425)
methyl6(benzylsulfanyl)4(4chlorophenyl)5cyano2oxo1234tetrahydropyridine3carboxylate
methyl6(benzylthio)4(4chlorophenyl)5cyano2oxo1234tetrahydropyridine3carboxylate
METHYL6BENZYLSULFANYL4(4CHLOROPHENYL)5CYANO2OXO34DIHYDRO1HPYRIDINE3CARBOXYLATE
MFCD03292002
ZINC000009013304
ZINC000009014739
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