Vitas-M small molecule compound
3'-benzyl-2-(4-chlorophenyl)-5-methyl-2',3',4',4a'-tetrahydro-1'H,6'H-spiro[pyrazole-4,5'-pyrido[1,2-a]quinolin]-3(2H)-one
Catalog ID
STL437371
SMILES Clc1ccc(cc1)N1N=C(C2(C1=O)Cc1ccccc1N1C2CC(CC1)Cc1ccccc1)C
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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 C29H28ClN3O MW 470.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28ClN3O/c1-20-29(28(34)33(31-20)25-13-11-24(30)12-14-25)19-23-9-5-6-10-26(23)32-16-15-22(18-27(29)32)17-21-7-3-2-4-8-21/h2-14,22,27H,15-19H2,1H3InChIKey
ASZCJUYKRBATFE-UHFFFAOYSA-NSynonyms
3benzyl2(4chlorophenyl)5methyl2344atetrahydro1H6Hspiro(pyrazole45pyrido(12a)quinolin)3(2H)one
3benzyl2(4chlorophenyl)5methylspiro(12344a6hexahydrobenzo(c)quinolizine54pyrazole)3one
CC1=NN(C(=O)C12CC3=CC=CC=C3N4C2CC(CC4)CC5=CC=CC=C5)C6=CC=C(C=C6)Cl
InChI=1SC29H28ClN3Oc12029(28(34)33(3120)25131124(30)121425)19239561026(23)32161522(1827(29)32)17217324821h2142227H1519H21H3
MFCD09992113
ZINC000025184713
ZINC000247991100
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