Vitas-M small molecule compound
11-{[(E)-(3-nitrophenyl)methylidene]amino}-3-phenyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL042788
SMILES O=c1n(cnc2c1c1nc3ccccc3nc1n2/N=C/c1cccc(c1)[N+](=O)[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 C25H15N7O3 MW 461.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H15N7O3/c33-25-21-22-24(29-20-12-5-4-11-19(20)28-22)31(27-14-16-7-6-10-18(13-16)32(34)35)23(21)26-15-30(25)17-8-2-1-3-9-17/h1-15H/b27-14+InChIKey
KZXQBNBTLQUBHW-MZJWZYIUSA-NSynonyms
713129-13-6(E)11((3nitrobenzylidene)amino)3phenyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
11(((E)(3nitrophenyl)methylidene)amino)3phenyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
713129136
C1=CC=C(C=C1)N2C=NC3=C(C2=O)C4=NC5=CC=CC=C5N=C4N3N=CC6=CC(=CC=C6)(N+)(=O)(O)
InChI=1SC25H15N7O3c3325212224(292012541119(20)2822)31(271416761018(1316)32(34)35)23(21)261530(25)178213917h115Hb2714+
MFCD04166872
O=c1n(cnc2c1c1nc3ccccc3nc1n2N=Cc1cccc(c1)(N+)(=O)(O))c1ccccc1
ZINC000013768902
ZINC33335007
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