Vitas-M small molecule compound
methyl 6-({2-[(2-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-4-(2-fluorophenyl)-2-methyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK827648
SMILES COC(=O)C1=C(C)NC(=C(C1c1ccccc1F)C#N)SCC(=O)Nc1ccccc1Cl
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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 C23H19ClFN3O3S MW 471.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19ClFN3O3S/c1-13-20(23(30)31-2)21(14-7-3-5-9-17(14)25)15(11-26)22(27-13)32-12-19(29)28-18-10-6-4-8-16(18)24/h3-10,21,27H,12H2,1-2H3,(H,28,29)InChIKey
UYJPRGXXNGXSFW-UHFFFAOYSA-NSynonyms
442557-59-7442557597
CC1=C(C(C(=C(N1)SCC(=O)NC2=CC=CC=C2Cl)C#N)C3=CC=CC=C3F)C(=O)OC
InChI=1SC23H19ClFN3O3Sc11320(23(30)312)21(14735917(14)25)15(1126)22(2713)321219(29)28181064816(18)24h3102127H12H212H3(H2829)
methyl6((2((2chlorophenyl)amino)2oxoethyl)sulfanyl)5cyano4(2fluorophenyl)2methyl14dihydropyridine3carboxylate
METHYL6((2((2CHLOROPHENYL)AMINO)2OXOETHYL)THIO)5CYANO4(2FLUOROPHENYL)2METHYL14DIHYDROPYRIDINE3CARBOXYLATE
METHYL6(2(2CHLOROANILINO)2OXOETHYL)SULFANYL5CYANO4(2FLUOROPHENYL)2METHYL14DIHYDROPYRIDINE3CARBOXYLATE
MFCD03981679
ZINC000003248454
ZINC000020348634
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