Vitas-M small molecule compound
3'-benzyl-5-methyl-2-phenyl-2',3',4',4a'-tetrahydro-1'H,6'H-spiro[pyrazole-4,5'-pyrido[1,2-a]quinolin]-3(2H)-one
Catalog ID
STL437316
SMILES CC1=NN(C(=O)C21Cc1ccccc1N1C2CC(CC1)Cc1ccccc1)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 C29H29N3O MW 435.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N3O/c1-21-29(28(33)32(30-21)25-13-6-3-7-14-25)20-24-12-8-9-15-26(24)31-17-16-23(19-27(29)31)18-22-10-4-2-5-11-22/h2-15,23,27H,16-20H2,1H3InChIKey
XSQHHQMZTNHFGM-UHFFFAOYSA-NSynonyms
3benzyl5methyl2phenyl2344atetrahydro1H6Hspiro(pyrazole45pyrido(12a)quinolin)3(2H)one
3benzyl5methyl2phenylspiro(12344a6hexahydrobenzo(c)quinolizine54pyrazole)3one
CC1=NN(C(=O)C12CC3=CC=CC=C3N4C2CC(CC4)CC5=CC=CC=C5)C6=CC=CC=C6
InChI=1SC29H29N3Oc12129(28(33)32(3021)25136371425)202412891526(24)31171623(1927(29)31)1822104251122h2152327H1620H21H3
MFCD09992059
ZINC000025184306
ZINC000248053097
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