Vitas-M small molecule compound
2-[4-(2,4-dimethoxyphenyl)-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
STK335396
SMILES COc1ccc(c(c1)OC)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 C30H27N3O5S MW 541.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27N3O5S/c1-16-26-27(20-11-10-18(37-2)15-24(20)38-3)28-21(13-17(14-23(28)34)25-9-6-12-39-25)31-29(26)33(32-16)22-8-5-4-7-19(22)30(35)36/h4-12,15,17,27,31H,13-14H2,1-3H3,(H,35,36)InChIKey
XFGQPLQBQPSOSC-UHFFFAOYSA-NSynonyms
2(4(24dimethoxyphenyl)3methyl5oxo7(thiophen2yl)456789hexahydro1Hpyrazolo(34b)quinolin1yl)benzoicacid
MFCD09963967
ZINC000102053346
ZINC000102053366
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