Vitas-M small molecule compound
5-cyano-N-(2,6-dimethylphenyl)-4-(furan-2-yl)-2-methyl-6-({2-[(2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK826435
SMILES N#CC1=C(SCC(=O)Nc2ccccc2C)NC(=C(C1c1ccco1)C(=O)Nc1c(C)cccc1C)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 C29H28N4O3S MW 512.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N4O3S/c1-17-9-5-6-12-22(17)32-24(34)16-37-29-21(15-30)26(23-13-8-14-36-23)25(20(4)31-29)28(35)33-27-18(2)10-7-11-19(27)3/h5-14,26,31H,16H2,1-4H3,(H,32,34)(H,33,35)InChIKey
JCCNWQUFUVQBTB-UHFFFAOYSA-NSynonyms
5cyanoN(26dimethylphenyl)4(furan2yl)2methyl6((2((2methylphenyl)amino)2oxoethyl)sulfanyl)14dihydropyridine3carboxamide
5cyanoN(26dimethylphenyl)4(furan2yl)2methyl6(2(2methylanilino)2oxoethyl)sulfanyl14dihydropyridine3carboxamide
CC1=C(C(=CC=C1)C)NC(=O)C2=C(NC(=C(C2C3=CC=CO3)C#N)SCC(=O)NC4=CC=CC=C4C)C
InChI=1SC29H28N4O3Sc1179561222(17)3224(34)16372921(1530)26(23138143623)25(20(4)3129)28(35)332718(2)1071119(27)3h5142631H16H214H3(H3234)(H3335)
MFCD10086357
ZINC000020347589
ZINC000020347591
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