Vitas-M small molecule compound
2-{4-[4-(benzyloxy)phenyl]-3-methyl-5-oxo-7-(thiophen-2-yl)-4,5,6,7,8,9-hexahydro-1H-pyrazolo[3,4-b]quinolin-1-yl}benzoic acid
Catalog ID
STK335237
SMILES O=C1CC(CC2=C1C(c1ccc(cc1)OCc1ccccc1)c1c(N2)n(nc1C)c1ccccc1C(=O)O)c1cccs1
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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 C35H29N3O4S MW 587.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H29N3O4S/c1-21-31-32(23-13-15-25(16-14-23)42-20-22-8-3-2-4-9-22)33-27(18-24(19-29(33)39)30-12-7-17-43-30)36-34(31)38(37-21)28-11-6-5-10-26(28)35(40)41/h2-17,24,32,36H,18-20H2,1H3,(H,40,41)InChIKey
WJESBEDJMDTQHC-UHFFFAOYSA-NSynonyms
2(4(4(benzyloxy)phenyl)3methyl5oxo7(thiophen2yl)456789hexahydro1Hpyrazolo(34b)quinolin1yl)benzoicacid
MFCD09963868
ZINC000102052349
ZINC000102052364
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