Vitas-M small molecule compound
methyl 2-({[8-chloro-2-(2-methylphenyl)quinolin-4-yl]carbonyl}amino)-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK443687
SMILES CCC1CCc2c(C1)sc(c2C(=O)OC)NC(=O)c1cc(nc2c1cccc2Cl)c1ccccc1C
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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/c1-4-17-12-13-20-24(14-17)36-28(25(20)29(34)35-3)32-27(33)21-15-23(18-9-6-5-8-16(18)2)31-26-19(21)10-7-11-22(26)30/h5-11,15,17H,4,12-14H2,1-3H3,(H,32,33)InChIKey
XLTMQDUWVXMKFB-UHFFFAOYSA-NSynonyms
CCC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3=CC(=NC4=C3C=CC=C4Cl)C5=CC=CC=C5C
InChI=1SC29H27ClN2O3Sc141712132024(1417)3628(25(20)29(34)353)3227(33)211523(18965816(18)2)312619(21)1071122(26)30h5111517H41214H213H3(H3233)
methyl2(((8chloro2(2methylphenyl)quinolin4yl)carbonyl)amino)6ethyl4567tetrahydro1benzothiophene3carboxylate
methyl2((8chloro2(2methylphenyl)quinoline4carbonyl)amino)6ethyl4567tetrahydro1benzothiophene3carboxylate
MFCD04054918
ZINC000020562987
ZINC000020562990
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