Vitas-M small molecule compound

2-{4-[3-(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
STK335244
SMILES O=C1CC(CC2=C1C(c1cccc(c1)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(23-11-7-12-25(17-23)42-20-22-9-3-2-4-10-22)33-27(18-24(19-29(33)39)30-15-8-16-43-30)36-34(31)38(37-21)28-14-6-5-13-26(28)35(40)41/h2-17,24,32,36H,18-20H2,1H3,(H,40,41)
InChIKey
NDHSEQCYZFUFDA-UHFFFAOYSA-N
Synonyms

2(4(3(benzyloxy)phenyl)3methyl5oxo7(thiophen2yl)456789hexahydro1Hpyrazolo(34b)quinolin1yl)benzoicacid
MFCD09963872
ZINC000102052387
ZINC000102052406

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Available files

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