Vitas-M small molecule compound

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

Catalog ID
STK763759
SMILES N#CC1=C(SCC(=O)Nc2ccc(c(c2)C)C)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1)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 C28H26N4O3S MW 498.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N4O3S/c1-17-11-12-21(14-18(17)2)31-24(33)16-36-28-22(15-29)26(23-10-7-13-35-23)25(19(3)30-28)27(34)32-20-8-5-4-6-9-20/h4-14,26,30H,16H2,1-3H3,(H,31,33)(H,32,34)
InChIKey
JCAIXENUOQYGBD-UHFFFAOYSA-N
Synonyms
361372-62-5
361372625
5cyano6((2((34dimethylphenyl)amino)2oxoethyl)sulfanyl)4(furan2yl)2methylNphenyl14dihydropyridine3carboxamide
5CYANO6((2((34DIMETHYLPHENYL)AMINO)2OXOETHYL)THIO)4(FURAN2YL)2METHYLNPHENYL14DIHYDROPYRIDINE3CARBOXAMIDE
5CYANO6((2(34DIMETHYLANILINO)2OXOETHYL)SULFANYL)4(2FURYL)2METHYLNPHENYL14DIHYDROPYRIDINE3CARBOXAMIDE
5CYANO6(2(34DIMETHYLANILINO)2OXOETHYL)SULFANYL4(FURAN2YL)2METHYLNPHENYL14DIHYDROPYRIDINE3CARBOXAMIDE
CC1=C(C=C(C=C1)NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC=C3)C4=CC=CO4)C#N)C
InChI=1SC28H26N4O3Sc117111221(1418(17)2)3124(33)16362822(1529)26(23107133523)25(19(3)3028)27(34)32208546920h4142630H16H213H3(H3133)(H3234)
MFCD02235538
ZINC000019831172
ZINC000019831174

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Available files

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