Vitas-M small molecule compound
8-bromo-5'-methyl-2'-(4-methylphenyl)-3-(pyridin-2-yl)-2,3,4,4a-tetrahydro-1H,6H-spiro[pyrazino[1,2-a]quinoline-5,4'-pyrazol]-3'(2'H)-one
Catalog ID
STL437363
SMILES Brc1ccc2c(c1)CC1(C3N2CCN(C3)c2ccccn2)C(=NN(C1=O)c1ccc(cc1)C)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 C27H26BrN5O MW 516.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26BrN5O/c1-18-6-9-22(10-7-18)33-26(34)27(19(2)30-33)16-20-15-21(28)8-11-23(20)32-14-13-31(17-24(27)32)25-5-3-4-12-29-25/h3-12,15,24H,13-14,16-17H2,1-2H3InChIKey
JQFMYEZPWCCJHB-UHFFFAOYSA-NSynonyms
8bromo5methyl2(4methylphenyl)3(pyridin2yl)2344atetrahydro1H6Hspiro(pyrazino(12a)quinoline54pyrazol)3(2H)one
8bromo5methyl2(4methylphenyl)3pyridin2ylspiro(244a6tetrahydro1Hpyrazino(12a)quinoline54pyrazole)3one
CC1=CC=C(C=C1)N2C(=O)C3(CC4=C(C=CC(=C4)Br)N5C3CN(CC5)C6=CC=CC=N6)C(=N2)C
InChI=1SC27H26BrN5Oc1186922(10718)3326(34)27(19(2)3033)16201521(28)81123(20)32141331(1724(27)32)25534122925h3121524H13141617H212H3
MFCD09992106
ZINC000033428994
ZINC000103899891
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