Vitas-M small molecule compound
2-methyl-11-{[(E)-(3-methylphenyl)methylidene]amino}-3-phenyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK714357
SMILES Cc1cccc(c1)/C=N/n1c2nc(C)n(c(=O)c2c2c1nc1ccccc1n2)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 C27H20N6O MW 444.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20N6O/c1-17-9-8-10-19(15-17)16-28-33-25-23(24-26(33)31-22-14-7-6-13-21(22)30-24)27(34)32(18(2)29-25)20-11-4-3-5-12-20/h3-16H,1-2H3/b28-16+InChIKey
XUIYKLIVRGPEPY-LQKURTRISA-NSynonyms
845805-95-0(E)2methyl11((3methylbenzylidene)amino)3phenyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
2methyl11(((E)(3methylphenyl)methylidene)amino)3phenyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
845805950
CC1=CC=CC(=C1)C=NN2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C(=N3)C)C6=CC=CC=C6
Cc1cccc(c1)C=Nn1c2nc(C)n(c(=O)c2c2c1nc1ccccc1n2)c1ccccc1
InChI=1SC27H20N6Oc117981019(1517)1628332523(2426(33)312214761321(22)3024)27(34)32(18(2)2925)20114351220h316H12H3b2816+
MFCD04170776
ZINC000002418361
ZINC2418360
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