Vitas-M small molecule compound
(4S,7S)-4-(4-ethoxyphenyl)-2-phenyl-7-(thiophen-2-yl)-4,7,8,9-tetrahydro-1H-pyrazolo[3,4-b]quinoline-3,5(2H,6H)-dione
Catalog ID
STK334792
SMILES CCOc1ccc(cc1)[C@H]1C2=C(C[C@@H](CC2=O)c2cccs2)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 C28H25N3O3S MW 483.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O3S/c1-2-34-20-12-10-17(11-13-20)24-25-21(15-18(16-22(25)32)23-9-6-14-35-23)29-27-26(24)28(33)31(30-27)19-7-4-3-5-8-19/h3-14,18,24,29-30H,2,15-16H2,1H3/t18-,24-/m0/s1InChIKey
MYZMWROOWOESPA-UUOWRZLLSA-NSynonyms
(4S7S)4(4ethoxyphenyl)2phenyl7(thiophen2yl)4789tetrahydro1Hpyrazolo(34b)quinoline35(2H6H)dione
(4S7S)4(4ethoxyphenyl)2phenyl7thiophen2yl146789hexahydropyrazolo(34b)quinoline35dione
CCOC1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC=CS4)NC5=C2C(=O)N(N5)C6=CC=CC=C6
CCOc1ccc(cc1)(C@H)1C2=C(C(C@@H)(CC2=O)c2cccs2)Nc2c1c(=O)n((nH)2)c1ccccc1
InChI=1SC28H25N3O3Sc123420121017(111320)242521(1518(1622(25)32)2396143523)292726(24)28(33)31(3027)197435819h31418242930H21516H21H3t1824m0s1
MFCD13368741
ZINC000012349596
ZINC12349596
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