Vitas-M small molecule compound
methyl 2-({[2-(4-chlorophenyl)-6-methylquinolin-4-yl]carbonyl}amino)-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK436941
SMILES CCC1CCc2c(C1)sc(c2C(=O)OC)NC(=O)c1cc(nc2c1cc(C)cc2)c1ccc(cc1)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/c1-4-17-6-11-20-25(14-17)36-28(26(20)29(34)35-3)32-27(33)22-15-24(18-7-9-19(30)10-8-18)31-23-12-5-16(2)13-21(22)23/h5,7-10,12-13,15,17H,4,6,11,14H2,1-3H3,(H,32,33)InChIKey
QOAXHBAHWCTVKY-UHFFFAOYSA-NSynonyms
CCC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3=CC(=NC4=C3C=C(C=C4)C)C5=CC=C(C=C5)Cl
InChI=1SC29H27ClN2O3Sc14176112025(1417)3628(26(20)29(34)353)3227(33)221524(187919(30)10818)312312516(2)1321(22)23h571012131517H461114H213H3(H3233)
methyl2(((2(4chlorophenyl)6methylquinolin4yl)carbonyl)amino)6ethyl4567tetrahydro1benzothiophene3carboxylate
methyl2((2(4chlorophenyl)6methylquinoline4carbonyl)amino)6ethyl4567tetrahydro1benzothiophene3carboxylate
MFCD03945225
ZINC000020562748
ZINC000020562751
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