Vitas-M small molecule compound
8'-bromo-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
STL437331
SMILES Brc1ccc2c(c1)CC1(C3N2CCCC3)C(=NN(C1=O)c1ccccc1)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 C22H22BrN3O MW 424.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22BrN3O/c1-15-22(21(27)26(24-15)18-7-3-2-4-8-18)14-16-13-17(23)10-11-19(16)25-12-6-5-9-20(22)25/h2-4,7-8,10-11,13,20H,5-6,9,12,14H2,1H3InChIKey
BPRMDKHXSGCKLD-UHFFFAOYSA-NSynonyms
8bromo5methyl2phenyl2344atetrahydro1H6Hspiro(pyrazole45pyrido(12a)quinolin)3(2H)one
8bromo5methyl2phenylspiro(12344a6hexahydrobenzo(c)quinolizine54pyrazole)3one
CC1=NN(C(=O)C12CC3=C(C=CC(=C3)Br)N4C2CCCC4)C5=CC=CC=C5
InChI=1SC22H22BrN3Oc11522(21(27)26(2415)187324818)14161317(23)101119(16)251265920(22)25h247810111320H5691214H21H3
MFCD09992074
ZINC000025184494
ZINC000103405374
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