Vitas-M small molecule compound
2-{4-[4-(2-ethoxy-2-oxoethoxy)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
STK335227
SMILES CCOC(=O)COc1ccc(cc1)C1C2=C(CC(CC2=O)c2cccs2)Nc2c1c(C)nn2c1ccccc1C(=O)O
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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 C32H29N3O6S MW 583.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29N3O6S/c1-3-40-27(37)17-41-21-12-10-19(11-13-21)29-28-18(2)34-35(24-8-5-4-7-22(24)32(38)39)31(28)33-23-15-20(16-25(36)30(23)29)26-9-6-14-42-26/h4-14,20,29,33H,3,15-17H2,1-2H3,(H,38,39)InChIKey
HBVMTMZJCUFXAG-UHFFFAOYSA-NSynonyms
2(4(4(2ethoxy2oxoethoxy)phenyl)3methyl5oxo7(thiophen2yl)456789hexahydro1Hpyrazolo(34b)quinolin1yl)benzoicacid
MFCD09963859
ZINC000102052271
ZINC000102052281
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