Vitas-M small molecule compound
11-{[(E)-(3-methoxyphenyl)methylidene]amino}-2-methyl-3-phenyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL234745
SMILES COc1cccc(c1)/C=N/n1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)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 C27H20N6O2 MW 460.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20N6O2/c1-17-29-25-23(27(34)32(17)19-10-4-3-5-11-19)24-26(31-22-14-7-6-13-21(22)30-24)33(25)28-16-18-9-8-12-20(15-18)35-2/h3-16H,1-2H3/b28-16+InChIKey
UZWLJZBEFQNBNP-LQKURTRISA-NSynonyms
844463-77-0(E)11((3methoxybenzylidene)amino)2methyl3phenyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
11(((E)(3methoxyphenyl)methylidene)amino)2methyl3phenyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
844463770
CC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2N=CC5=CC(=CC=C5)OC)C(=O)N1C6=CC=CC=C6
COc1cccc(c1)C=Nn1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)c1ccccc1
InChI=1SC27H20N6O2c117292523(27(34)32(17)19104351119)2426(312214761321(22)3024)33(25)281618981220(1518)352h316H12H3b2816+
MFCD04157790
ZINC000002403236
ZINC33365595
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