Vitas-M small molecule compound
6-({2-[(3-chloro-2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-5-cyano-N-(2-methoxyphenyl)-2-methyl-4-(5-methylfuran-2-yl)-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK538273
SMILES N#CC1=C(SCC(=O)Nc2cccc(c2C)Cl)NC(=C(C1c1ccc(o1)C)C(=O)Nc1ccccc1OC)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 C29H27ClN4O4S MW 563.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27ClN4O4S/c1-16-12-13-24(38-16)27-19(14-31)29(39-15-25(35)33-21-10-7-8-20(30)17(21)2)32-18(3)26(27)28(36)34-22-9-5-6-11-23(22)37-4/h5-13,27,32H,15H2,1-4H3,(H,33,35)(H,34,36)InChIKey
MPCMNNQCFRNRIT-UHFFFAOYSA-NSynonyms
6((2((3chloro2methylphenyl)amino)2oxoethyl)sulfanyl)5cyanoN(2methoxyphenyl)2methyl4(5methylfuran2yl)14dihydropyridine3carboxamide
6((2((3chloro2methylphenyl)amino)2oxoethyl)thio)5cyanoN(2methoxyphenyl)2methyl4(5methylfuran2yl)14dihydropyridine3carboxamide
6(2(3CHLORO2METHYLANILINO)2OXOETHYL)SULFANYL5CYANON(2METHOXYPHENYL)2METHYL4(5METHYLFURAN2YL)14DIHYDROPYRIDINE3CARBOXAMIDE
CC1=CC=C(O1)C2C(=C(NC(=C2C(=O)NC3=CC=CC=C3OC)C)SCC(=O)NC4=C(C(=CC=C4)Cl)C)C#N
InChI=1SC29H27ClN4O4Sc116121324(3816)2719(1431)29(391525(35)3321107820(30)17(21)2)3218(3)26(27)28(36)34229561123(22)374h5132732H15H214H3(H3335)(H3436)
MFCD03000555
ZINC000001308548
ZINC000001308549
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