Vitas-M small molecule compound
(4S,7S)-7-(3,4-dimethoxyphenyl)-4-(4-ethoxyphenyl)-2-phenyl-4,7,8,9-tetrahydro-1H-pyrazolo[3,4-b]quinoline-3,5(2H,6H)-dione
Catalog ID
STK335288
SMILES CCOc1ccc(cc1)[C@H]1C2=C(C[C@@H](CC2=O)c2ccc(c(c2)OC)OC)Nc2c1c(=O)n([nH]2)c1ccccc1
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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 C32H31N3O5 MW 537.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H31N3O5/c1-4-40-23-13-10-19(11-14-23)28-29-24(33-31-30(28)32(37)35(34-31)22-8-6-5-7-9-22)16-21(17-25(29)36)20-12-15-26(38-2)27(18-20)39-3/h5-15,18,21,28,33-34H,4,16-17H2,1-3H3/t21-,28-/m0/s1InChIKey
WVQKAEQJWOKFQJ-KMRXNPHXSA-NSynonyms
(4S7S)7(34dimethoxyphenyl)4(4ethoxyphenyl)2phenyl146789hexahydropyrazolo(34b)quinoline35dione
(4S7S)7(34dimethoxyphenyl)4(4ethoxyphenyl)2phenyl4789tetrahydro1Hpyrazolo(34b)quinoline35(2H6H)dione
CCOC1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC(=C(C=C4)OC)OC)NC5=C2C(=O)N(N5)C6=CC=CC=C6
CCOc1ccc(cc1)(C@H)1C2=C(C(C@@H)(CC2=O)c2ccc(c(c2)OC)OC)Nc2c1c(=O)n((nH)2)c1ccccc1
InChI=1SC32H31N3O5c144023131019(111423)282924(333130(28)32(37)35(3431)228657922)1621(1725(29)36)20121526(382)27(1820)393h5151821283334H41617H213H3t2128m0s1
MFCD13368797
ZINC000102052703
ZINC102052703
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