4-[1-(4-azanylbutyl)indol-3-yl]-3-(4-methoxyphenyl)-2-oxidanylidene-1H-imidazole-5-carbonitrile

Systemtic Name: 4-[1-(4-azanylbutyl)indol-3-yl]-3-(4-methoxyphenyl)-2-oxidanylidene-1H-imidazole-5-carbonitrile Openeye Name: 4-[1-(4-aminobutyl)indol-3-yl]-3-(4-methoxyphenyl)-2-oxo-1H-imidazole-5-carbonitrile CAS Name: 4-[1-(4-aminobutyl)-3-indolyl]-3-(4-methoxyphenyl)-2-oxo-1H-imidazole-5-carbonitrile IUPAC Name: 4-[1-(4-aminobutyl)indol-3-yl]-3-(4-methoxyphenyl)-2-oxo-1H-imidazole-5-carbonitrile Traditional Name: 5-[1-(4-aminobutyl)indol-3-yl]-2-keto-1-(4-methoxyphenyl)-4-imidazoline-4-carbonitrile Formula: C23H23N5O2 MolecularWeight: 401.46102

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=C(NC2=O)C#N)C3=CN(C4=CC=CC=C43)CCCCN

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=C(NC2=O)C#N)C3=CN(C4=CC=CC=C43)CCCCN

InChI

InChI=1S/C23H23N5O2/c1-30-17-10-8-16(9-11-17)28-22(20(14-25)26-23(28)29)19-15-27(13-5-4-12-24)21-7-3-2-6-18(19)21/h2-3,6-11,15H,4-5,12-13,24H2,1H3,(H,26,29)