Vitas-M small molecule compound
5-cyano-N-(2-fluorophenyl)-4-(furan-2-yl)-2-methyl-6-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK826586
SMILES N#CC1=C(SCC(=O)c2ccc(cc2)C)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 C27H22FN3O3S MW 487.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22FN3O3S/c1-16-9-11-18(12-10-16)22(32)15-35-27-19(14-29)25(23-8-5-13-34-23)24(17(2)30-27)26(33)31-21-7-4-3-6-20(21)28/h3-13,25,30H,15H2,1-2H3,(H,31,33)InChIKey
PBVABYKITAUIGZ-UHFFFAOYSA-NSynonyms
692771-30-55cyanoN(2fluorophenyl)4(furan2yl)2methyl6((2(4methylphenyl)2oxoethyl)sulfanyl)14dihydropyridine3carboxamide
5cyanoN(2fluorophenyl)4(furan2yl)2methyl6((2oxo2(ptolyl)ethyl)thio)14dihydropyridine3carboxamide
5CYANON(2FLUOROPHENYL)4(FURAN2YL)2METHYL6(2(4METHYLPHENYL)2OXOETHYL)SULFANYL14DIHYDROPYRIDINE3CARBOXAMIDE
692771305
CC1=CC=C(C=C1)C(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC=C3F)C4=CC=CO4)C#N
InChI=1SC27H22FN3O3Sc11691118(121016)22(32)15352719(1429)25(2385133423)24(17(2)3027)26(33)3121743620(21)28h3132530H15H212H3(H3133)
MFCD03669961
ZINC000001136875
ZINC000001136876
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