(3E)-3-[[(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)amino]-phenyl-methylidene]-5-nitro-1H-indol-2-one

Systemtic Name: (3E)-3-[[(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)amino]-phenyl-methylidene]-5-nitro-1H-indol-2-one Openeye Name: (3E)-3-[(4-imidazo[1,2-a]pyrimidin-2-ylanilino)-phenyl-methylene]-5-nitro-indolin-2-one CAS Name: (3E)-3-[[4-(2-imidazo[1,2-a]pyrimidinyl)anilino]-phenylmethylidene]-5-nitro-1H-indol-2-one IUPAC Name: (3E)-3-[(4-imidazo[1,2-a]pyrimidin-2-ylanilino)-phenylmethylidene]-5-nitro-1H-indol-2-one Traditional Name: (3E)-3-[(4-imidazo[1,2-a]pyrimidin-2-ylanilino)-phenyl-methylene]-5-nitro-oxindole Formula: C27H18N6O3 MolecularWeight: 474.47022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=C2C3=C(C=CC(=C3)[N+](=O)[O-])NC2=O)NC4=CC=C(C=C4)C5=CN6C=CC=NC6=N5

Isomeric SMILES

C1=CC=C(C=C1)/C(=C\2/C3=C(C=CC(=C3)[N+](=O)[O-])NC2=O)/NC4=CC=C(C=C4)C5=CN6C=CC=NC6=N5

InChI

InChI=1S/C27H18N6O3/c34-26-24(21-15-20(33(35)36)11-12-22(21)30-26)25(18-5-2-1-3-6-18)29-19-9-7-17(8-10-19)23-16-32-14-4-13-28-27(32)31-23/h1-16,29H,(H,30,34)/b25-24+