Vitas-M small molecule compound
2-{3-methyl-5-oxo-4-[4-(propan-2-yl)phenyl]-7-(thiophen-2-yl)-4,5,6,7,8,9-hexahydro-1H-pyrazolo[3,4-b]quinolin-1-yl}benzoic acid
Catalog ID
STK335360
SMILES CC(c1ccc(cc1)C1C2=C(CC(CC2=O)c2cccs2)Nc2c1c(C)nn2c1ccccc1C(=O)O)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 C31H29N3O3S MW 523.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N3O3S/c1-17(2)19-10-12-20(13-11-19)28-27-18(3)33-34(24-8-5-4-7-22(24)31(36)37)30(27)32-23-15-21(16-25(35)29(23)28)26-9-6-14-38-26/h4-14,17,21,28,32H,15-16H2,1-3H3,(H,36,37)InChIKey
QGETYLJENXUMQL-UHFFFAOYSA-NSynonyms
2(3methyl5oxo4(4(propan2yl)phenyl)7(thiophen2yl)456789hexahydro1Hpyrazolo(34b)quinolin1yl)benzoicacid
MFCD09963949
ZINC000018198750
ZINC000018198755
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