Vitas-M small molecule compound
methyl 2-({[2-(3-chlorophenyl)-3-methylquinolin-4-yl]carbonyl}amino)-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK426030
SMILES COC(=O)c1c(NC(=O)c2c(C)c(nc3c2cccc3)c2cccc(c2)Cl)sc2c1CCC(C2)C(CC)(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 C32H33ClN2O3S MW 561.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H33ClN2O3S/c1-6-32(3,4)20-14-15-23-25(17-20)39-30(27(23)31(37)38-5)35-29(36)26-18(2)28(19-10-9-11-21(33)16-19)34-24-13-8-7-12-22(24)26/h7-13,16,20H,6,14-15,17H2,1-5H3,(H,35,36)InChIKey
QFBYBYHIWQYXER-UHFFFAOYSA-NSynonyms
CCC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3=C(C(=NC4=CC=CC=C43)C5=CC(=CC=C5)Cl)C
InChI=1SC32H33ClN2O3Sc1632(34)2014152325(1720)3930(27(23)31(37)385)3529(36)2618(2)28(191091121(33)1619)342413871222(24)26h7131620H6141517H215H3(H3536)
methyl2(((2(3chlorophenyl)3methylquinolin4yl)carbonyl)amino)6(2methylbutan2yl)4567tetrahydro1benzothiophene3carboxylate
methyl2((2(3chlorophenyl)3methylquinoline4carbonyl)amino)6(2methylbutan2yl)4567tetrahydro1benzothiophene3carboxylate
MFCD02608464
ZINC000002108231
ZINC000002108233
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