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

Systemtic Name: 4-[1-(4-azanylbutyl)indol-3-yl]-3-(4-tert-butylphenyl)-2-oxidanylidene-1H-imidazole-5-carbonitrile Openeye Name: 4-[1-(4-aminobutyl)indol-3-yl]-3-(4-tert-butylphenyl)-2-oxo-1H-imidazole-5-carbonitrile CAS Name: 4-[1-(4-aminobutyl)-3-indolyl]-3-(4-tert-butylphenyl)-2-oxo-1H-imidazole-5-carbonitrile IUPAC Name: 4-[1-(4-aminobutyl)indol-3-yl]-3-(4-tert-butylphenyl)-2-oxo-1H-imidazole-5-carbonitrile Traditional Name: 5-[1-(4-aminobutyl)indol-3-yl]-1-(4-tert-butylphenyl)-2-keto-4-imidazoline-4-carbonitrile Formula: C26H29N5O MolecularWeight: 427.54136

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H29N5O/c1-26(2,3)18-10-12-19(13-11-18)31-24(22(16-28)29-25(31)32)21-17-30(15-7-6-14-27)23-9-5-4-8-20(21)23/h4-5,8-13,17H,6-7,14-15,27H2,1-3H3,(H,29,32)