Vitas-M small molecule compound
6-({2-[(3-chloro-2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-N-(2-fluorophenyl)-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK826613
SMILES N#CC1=C(SCC(=O)Nc2cccc(c2C)Cl)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1F)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 C27H22ClFN4O3S MW 537.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22ClFN4O3S/c1-15-18(28)7-5-10-20(15)32-23(34)14-37-27-17(13-30)25(22-11-6-12-36-22)24(16(2)31-27)26(35)33-21-9-4-3-8-19(21)29/h3-12,25,31H,14H2,1-2H3,(H,32,34)(H,33,35)InChIKey
SGTKOMNICUYVTD-UHFFFAOYSA-NSynonyms
6((2((3chloro2methylphenyl)amino)2oxoethyl)sulfanyl)5cyanoN(2fluorophenyl)4(furan2yl)2methyl14dihydropyridine3carboxamide
6(2(3CHLORO2METHYLANILINO)2OXOETHYL)SULFANYL5CYANON(2FLUOROPHENYL)4(FURAN2YL)2METHYL14DIHYDROPYRIDINE3CARBOXAMIDE
CC1=C(C=CC=C1Cl)NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC=C3F)C4=CC=CO4)C#N
InChI=1SC27H22ClFN4O3Sc11518(28)751020(15)3223(34)14372717(1330)25(22116123622)24(16(2)3127)26(35)3321943819(21)29h3122531H14H212H3(H3234)(H3335)
MFCD03723938
ZINC000001144661
ZINC000001144662
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