3-[[3-(cyclohexylmethyl)-2-oxidanylidene-6-phenylazanyl-1H-benzimidazol-5-yl]-methyl-amino]propanenitrile

Systemtic Name: 3-[[3-(cyclohexylmethyl)-2-oxidanylidene-6-phenylazanyl-1H-benzimidazol-5-yl]-methyl-amino]propanenitrile Openeye Name: 3-[[6-anilino-3-(cyclohexylmethyl)-2-oxo-1H-benzimidazol-5-yl]-methyl-amino]propanenitrile CAS Name: 3-[[6-anilino-3-(cyclohexylmethyl)-2-oxo-1H-benzimidazol-5-yl]-methylamino]propanenitrile IUPAC Name: 3-[[6-anilino-3-(cyclohexylmethyl)-2-oxo-1H-benzimidazol-5-yl]-methylamino]propanenitrile Traditional Name: 3-[[6-anilino-3-(cyclohexylmethyl)-2-keto-1H-benzimidazol-5-yl]-methyl-amino]propionitrile Formula: C24H29N5O MolecularWeight: 403.51996

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C1=C(C=C2C(=C1)N(C(=O)N2)CC3CCCCC3)NC4=CC=CC=C4

Isomeric SMILES

CN(CCC#N)C1=C(C=C2C(=C1)N(C(=O)N2)CC3CCCCC3)NC4=CC=CC=C4

InChI

InChI=1S/C24H29N5O/c1-28(14-8-13-25)22-16-23-21(15-20(22)26-19-11-6-3-7-12-19)27-24(30)29(23)17-18-9-4-2-5-10-18/h3,6-7,11-12,15-16,18,26H,2,4-5,8-10,14,17H2,1H3,(H,27,30)