Vitas-M small molecule compound

(4R,7S)-4-[4-(diethylamino)phenyl]-3-hydroxy-7-(thiophen-2-yl)-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one

Catalog ID
STK333917
SMILES CCN(c1ccc(cc1)[C@H]1C2=C(C[C@@H](CC2=O)c2cccs2)Nc2c1c(O)n[nH]2)CC

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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 C24H26N4O2S MW 434.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N4O2S/c1-3-28(4-2)16-9-7-14(8-10-16)20-21-17(25-23-22(20)24(30)27-26-23)12-15(13-18(21)29)19-6-5-11-31-19/h5-11,15,20H,3-4,12-13H2,1-2H3,(H3,25,26,27,30)/t15-,20-/m0/s1
InChIKey
QKSGMPBKCRYXNI-YWZLYKJASA-N
Synonyms

(4R7S)4(4(diethylamino)phenyl)3hydroxy7(thiophen2yl)146789hexahydro5Hpyrazolo(34b)quinolin5one
(4S7S)4(4(diethylamino)phenyl)7thiophen2yl246789hexahydro1Hpyrazolo(34b)quinoline35dione
CCN(c1ccc(cc1)(C@H)1C2=C(C(C@@H)(CC2=O)c2cccs2)Nc2c1c(O)n(nH)2)CC
CCN(CC)C1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC=CS4)NC5=C2C(=O)NN5
InChI=1SC24H26N4O2Sc1328(42)169714(81016)202117(252322(20)24(30)272623)1215(1318(21)29)1965113119h5111520H341213H212H3(H325262730)t1520m0s1
MFCD13368653
ZINC000018196493
ZINC18196493

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Available files

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