3-(1-methylindol-3-yl)-2-oxidanylidene-4-[1-(3-piperazin-1-ylpropyl)indol-3-yl]-1H-imidazole-5-carbonitrile

Systemtic Name: 3-(1-methylindol-3-yl)-2-oxidanylidene-4-[1-(3-piperazin-1-ylpropyl)indol-3-yl]-1H-imidazole-5-carbonitrile Openeye Name: 3-(1-methylindol-3-yl)-2-oxo-4-[1-(3-piperazin-1-ylpropyl)indol-3-yl]-1H-imidazole-5-carbonitrile CAS Name: 3-(1-methyl-3-indolyl)-2-oxo-4-[1-[3-(1-piperazinyl)propyl]-3-indolyl]-1H-imidazole-5-carbonitrile IUPAC Name: 3-(1-methylindol-3-yl)-2-oxo-4-[1-(3-piperazin-1-ylpropyl)indol-3-yl]-1H-imidazole-5-carbonitrile Traditional Name: 2-keto-1-(1-methylindol-3-yl)-5-[1-(3-piperazinopropyl)indol-3-yl]-4-imidazoline-4-carbonitrile Formula: C28H29N7O MolecularWeight: 479.57616

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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)CCCN6CCNCC6

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)N3C(=C(NC3=O)C#N)C4=CN(C5=CC=CC=C54)CCCN6CCNCC6

InChI

InChI=1S/C28H29N7O/c1-32-19-26(21-8-3-4-9-24(21)32)35-27(23(17-29)31-28(35)36)22-18-34(25-10-5-2-7-20(22)25)14-6-13-33-15-11-30-12-16-33/h2-5,7-10,18-19,30H,6,11-16H2,1H3,(H,31,36)