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

Systemtic Name: 4-[1-[[5-(aminomethyl)thiophen-2-yl]methyl]indol-3-yl]-3-(1-methylindol-3-yl)-2-oxidanylidene-1H-imidazole-5-carbonitrile Openeye Name: 4-[1-[[5-(aminomethyl)-2-thienyl]methyl]indol-3-yl]-3-(1-methylindol-3-yl)-2-oxo-1H-imidazole-5-carbonitrile CAS Name: 4-[1-[[5-(aminomethyl)-2-thiophenyl]methyl]-3-indolyl]-3-(1-methyl-3-indolyl)-2-oxo-1H-imidazole-5-carbonitrile IUPAC Name: 4-[1-[[5-(aminomethyl)thiophen-2-yl]methyl]indol-3-yl]-3-(1-methylindol-3-yl)-2-oxo-1H-imidazole-5-carbonitrile Traditional Name: 5-[1-[[5-(aminomethyl)-2-thienyl]methyl]indol-3-yl]-2-keto-1-(1-methylindol-3-yl)-4-imidazoline-4-carbonitrile Formula: C27H22N6OS MolecularWeight: 478.56818

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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=C(S6)CN

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)N3C(=C(NC3=O)C#N)C4=CN(C5=CC=CC=C54)CC6=CC=C(S6)CN

InChI

InChI=1S/C27H22N6OS/c1-31-16-25(20-7-3-4-8-23(20)31)33-26(22(13-29)30-27(33)34)21-15-32(24-9-5-2-6-19(21)24)14-18-11-10-17(12-28)35-18/h2-11,15-16H,12,14,28H2,1H3,(H,30,34)