Vitas-M small molecule compound
5-cyano-6-({2-[(4-ethylphenyl)amino]-2-oxoethyl}sulfanyl)-4-(furan-2-yl)-N-(2-methoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK535448
SMILES N#CC1=C(SCC(=O)Nc2ccc(cc2)CC)NC(=C(C1c1ccco1)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 C29H28N4O4S MW 528.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N4O4S/c1-4-19-11-13-20(14-12-19)32-25(34)17-38-29-21(16-30)27(24-10-7-15-37-24)26(18(2)31-29)28(35)33-22-8-5-6-9-23(22)36-3/h5-15,27,31H,4,17H2,1-3H3,(H,32,34)(H,33,35)InChIKey
TUGPAAMVYDMINJ-UHFFFAOYSA-NSynonyms
5cyano6((2((4ethylphenyl)amino)2oxoethyl)sulfanyl)4(furan2yl)N(2methoxyphenyl)2methyl14dihydropyridine3carboxamide
5cyano6((2((4ethylphenyl)amino)2oxoethyl)thio)4(furan2yl)N(2methoxyphenyl)2methyl14dihydropyridine3carboxamide
5CYANO6(2(4ETHYLANILINO)2OXOETHYL)SULFANYL4(FURAN2YL)N(2METHOXYPHENYL)2METHYL14DIHYDROPYRIDINE3CARBOXAMIDE
CCC1=CC=C(C=C1)NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC=C3OC)C4=CC=CO4)C#N
InChI=1SC29H28N4O4Sc1419111320(141219)3225(34)17382921(1630)27(24107153724)26(18(2)3129)28(35)3322856923(22)363h5152731H417H213H3(H3234)(H3335)
MFCD02241636
ZINC000001171770
ZINC000059735951
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