Vitas-M small molecule compound

5-cyano-N-(2-fluorophenyl)-4-(furan-2-yl)-2-methyl-6-({2-[(2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-1,4-dihydropyridine-3-carboxamide

Catalog ID
STK549889
SMILES N#CC1=C(SCC(=O)Nc2ccccc2C)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 C27H23FN4O3S MW 502.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23FN4O3S/c1-16-8-3-5-10-20(16)31-23(33)15-36-27-18(14-29)25(22-12-7-13-35-22)24(17(2)30-27)26(34)32-21-11-6-4-9-19(21)28/h3-13,25,30H,15H2,1-2H3,(H,31,33)(H,32,34)
InChIKey
FZAAPRLIBGHGJR-UHFFFAOYSA-N
Synonyms
799772-68-2
5cyanoN(2fluorophenyl)4(furan2yl)2methyl6((2((2methylphenyl)amino)2oxoethyl)sulfanyl)14dihydropyridine3carboxamide
5cyanoN(2fluorophenyl)4(furan2yl)2methyl6((2oxo2(otolylamino)ethyl)thio)14dihydropyridine3carboxamide
5CYANON(2FLUOROPHENYL)4(FURAN2YL)2METHYL6(2(2METHYLANILINO)2OXOETHYL)SULFANYL14DIHYDROPYRIDINE3CARBOXAMIDE
5CYANON(2FLUOROPHENYL)4FURAN2YL2METHYL6((2((2METHYLPHENYL)AMINO)2OXOETHYL)SULFANYL)14DIHYDROPYRIDINE3CARBOXAMIDE
799772682
CC1=CC=CC=C1NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC=C3F)C4=CC=CO4)C#N
InChI=1SC27H23FN4O3Sc1168351020(16)3123(33)15362718(1429)25(22127133522)24(17(2)3027)26(34)32211164919(21)28h3132530H15H212H3(H3133)(H3234)
MFCD03672362
ZINC000020170811
ZINC000020170813

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.