4-[1-[[2-(aminomethyl)phenyl]methyl]indol-3-yl]-3-(1-methylindol-3-yl)-2-oxidanylidene-1H-imidazole-5-carbonitrile

Systemtic Name: 4-[1-[[2-(aminomethyl)phenyl]methyl]indol-3-yl]-3-(1-methylindol-3-yl)-2-oxidanylidene-1H-imidazole-5-carbonitrile Openeye Name: 4-[1-[[2-(aminomethyl)phenyl]methyl]indol-3-yl]-3-(1-methylindol-3-yl)-2-oxo-1H-imidazole-5-carbonitrile CAS Name: 4-[1-[[2-(aminomethyl)phenyl]methyl]-3-indolyl]-3-(1-methyl-3-indolyl)-2-oxo-1H-imidazole-5-carbonitrile IUPAC Name: 4-[1-[[2-(aminomethyl)phenyl]methyl]indol-3-yl]-3-(1-methylindol-3-yl)-2-oxo-1H-imidazole-5-carbonitrile Traditional Name: 5-[1-[2-(aminomethyl)benzyl]indol-3-yl]-2-keto-1-(1-methylindol-3-yl)-4-imidazoline-4-carbonitrile Formula: C29H24N6O MolecularWeight: 472.54046

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)N3C(=C(NC3=O)C#N)C4=CN(C5=CC=CC=C54)CC6=CC=CC=C6CN

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)N3C(=C(NC3=O)C#N)C4=CN(C5=CC=CC=C54)CC6=CC=CC=C6CN

InChI

InChI=1S/C29H24N6O/c1-33-18-27(22-11-5-6-12-25(22)33)35-28(24(15-31)32-29(35)36)23-17-34(26-13-7-4-10-21(23)26)16-20-9-3-2-8-19(20)14-30/h2-13,17-18H,14,16,30H2,1H3,(H,32,36)