Vitas-M small molecule compound
5-cyano-6-({2-[(2,5-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-4-(furan-2-yl)-2-methyl-N-(3-methylphenyl)-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK826707
SMILES N#CC1=C(SCC(=O)Nc2cc(C)ccc2C)NC(=C(C1c1ccco1)C(=O)Nc1cccc(c1)C)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/c1-17-7-5-8-21(13-17)32-28(35)26-20(4)31-29(22(15-30)27(26)24-9-6-12-36-24)37-16-25(34)33-23-14-18(2)10-11-19(23)3/h5-14,27,31H,16H2,1-4H3,(H,32,35)(H,33,34)InChIKey
GTXVMECHBAPZDZ-UHFFFAOYSA-NSynonyms
5cyano6((2((25dimethylphenyl)amino)2oxoethyl)sulfanyl)4(furan2yl)2methylN(3methylphenyl)14dihydropyridine3carboxamide
5cyano6(2(25dimethylanilino)2oxoethyl)sulfanyl4(furan2yl)2methylN(3methylphenyl)14dihydropyridine3carboxamide
CC1=CC(=CC=C1)NC(=O)C2=C(NC(=C(C2C3=CC=CO3)C#N)SCC(=O)NC4=C(C=CC(=C4)C)C)C
InChI=1SC29H28N4O3Sc11775821(1317)3228(35)2620(4)3129(22(1530)27(26)2496123624)371625(34)33231418(2)101119(23)3h5142731H16H214H3(H3235)(H3334)
MFCD10086647
ZINC000012250453
ZINC000012250454
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