Vitas-M small molecule compound
methyl 2-({[2-(3-chlorophenyl)-3-methylquinolin-4-yl]carbonyl}amino)-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK426028
SMILES CCC1CCc2c(C1)sc(c2C(=O)OC)NC(=O)c1c(C)c(nc2c1cccc2)c1cccc(c1)Cl
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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 C29H27ClN2O3S MW 519.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27ClN2O3S/c1-4-17-12-13-21-23(14-17)36-28(25(21)29(34)35-3)32-27(33)24-16(2)26(18-8-7-9-19(30)15-18)31-22-11-6-5-10-20(22)24/h5-11,15,17H,4,12-14H2,1-3H3,(H,32,33)InChIKey
GWIPPWRMAKYCEN-UHFFFAOYSA-NSynonyms
CCC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3=C(C(=NC4=CC=CC=C43)C5=CC(=CC=C5)Cl)C
InChI=1SC29H27ClN2O3Sc141712132123(1417)3628(25(21)29(34)353)3227(33)2416(2)26(1887919(30)1518)312211651020(22)24h5111517H41214H213H3(H3233)
methyl2(((2(3chlorophenyl)3methylquinolin4yl)carbonyl)amino)6ethyl4567tetrahydro1benzothiophene3carboxylate
methyl2((2(3chlorophenyl)3methylquinoline4carbonyl)amino)6ethyl4567tetrahydro1benzothiophene3carboxylate
MFCD02608474
ZINC000002108254
ZINC000002108256
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