Vitas-M small molecule compound
5-cyano-6-({2-[(2,5-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK763771
SMILES N#CC1=C(SCC(=O)Nc2cc(C)ccc2C)NC(=C(C1c1cccs1)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 C28H26N4O2S2 MW 514.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N4O2S2/c1-17-11-12-18(2)22(14-17)32-24(33)16-36-28-21(15-29)26(23-10-7-13-35-23)25(19(3)30-28)27(34)31-20-8-5-4-6-9-20/h4-14,26,30H,16H2,1-3H3,(H,31,34)(H,32,33)InChIKey
NMIQBCLCFCFIGG-UHFFFAOYSA-NSynonyms
5cyano6((2((25dimethylphenyl)amino)2oxoethyl)sulfanyl)2methylNphenyl4(thiophen2yl)14dihydropyridine3carboxamide
5cyano6((2((25dimethylphenyl)amino)2oxoethyl)thio)2methylNphenyl4(thiophen2yl)14dihydropyridine3carboxamide
5CYANO6(2(25DIMETHYLANILINO)2OXOETHYL)SULFANYL2METHYLNPHENYL4THIOPHEN2YL14DIHYDROPYRIDINE3CARBOXAMIDE
CC1=CC(=C(C=C1)C)NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC=C3)C4=CC=CS4)C#N
InChI=1SC28H26N4O2S2c117111218(2)22(1417)3224(33)16362821(1529)26(23107133523)25(19(3)3028)27(34)31208546920h4142630H16H213H3(H3134)(H3233)
MFCD02239096
ZINC000001241564
ZINC000001241565
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