Vitas-M small molecule compound
methyl 2-({[2-(3,4-dimethoxyphenyl)quinolin-4-yl]carbonyl}amino)-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK426512
SMILES COC(=O)c1c(NC(=O)c2cc(nc3c2cccc3)c2ccc(c(c2)OC)OC)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 C33H36N2O5S MW 572.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H36N2O5S/c1-7-33(2,3)20-13-14-22-28(17-20)41-31(29(22)32(37)40-6)35-30(36)23-18-25(34-24-11-9-8-10-21(23)24)19-12-15-26(38-4)27(16-19)39-5/h8-12,15-16,18,20H,7,13-14,17H2,1-6H3,(H,35,36)InChIKey
BZODFKLWKOAKSQ-UHFFFAOYSA-NSynonyms
CCC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC(=C(C=C5)OC)OC
InChI=1SC33H36N2O5Sc1733(23)2013142228(1720)4131(29(22)32(37)406)3530(36)231825(342411981021(23)24)19121526(384)27(1619)395h81215161820H7131417H216H3(H3536)
methyl2(((2(34dimethoxyphenyl)quinolin4yl)carbonyl)amino)6(2methylbutan2yl)4567tetrahydro1benzothiophene3carboxylate
methyl2((2(34dimethoxyphenyl)quinoline4carbonyl)amino)6(2methylbutan2yl)4567tetrahydro1benzothiophene3carboxylate
MFCD01344884
ZINC000002081568
ZINC000002081569
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