6-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)-5-ethyl-4-imidazol-1-yl-7-(3-methylphenyl)isoindole-1,3-dione

Systemtic Name: 6-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)-5-ethyl-4-imidazol-1-yl-7-(3-methylphenyl)isoindole-1,3-dione Openeye Name: 6-(1,3-dimethyl-2-oxo-benzimidazol-5-yl)-5-ethyl-4-imidazol-1-yl-7-(m-tolyl)isoindoline-1,3-dione CAS Name: 6-(1,3-dimethyl-2-oxo-5-benzimidazolyl)-5-ethyl-4-(1-imidazolyl)-7-(3-methylphenyl)isoindole-1,3-dione IUPAC Name: 6-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-5-ethyl-4-imidazol-1-yl-7-(3-methylphenyl)isoindole-1,3-dione Traditional Name: 5-ethyl-4-imidazol-1-yl-6-(2-keto-1,3-dimethyl-benzimidazol-5-yl)-7-(m-tolyl)isoindoline-1,3-quinone Formula: C29H25N5O3 MolecularWeight: 491.5405

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C(=C1C3=CC4=C(C=C3)N(C(=O)N4C)C)C5=CC(=CC=C5)C)C(=O)NC2=O)N6C=CN=C6

Isomeric SMILES

CCC1=C(C2=C(C(=C1C3=CC4=C(C=C3)N(C(=O)N4C)C)C5=CC(=CC=C5)C)C(=O)NC2=O)N6C=CN=C6

InChI

InChI=1S/C29H25N5O3/c1-5-19-22(18-9-10-20-21(14-18)33(4)29(37)32(20)3)23(17-8-6-7-16(2)13-17)24-25(28(36)31-27(24)35)26(19)34-12-11-30-15-34/h6-15H,5H2,1-4H3,(H,31,35,36)