1-[3-(cyclohexylmethyl)-2-oxidanylidene-6-phenylazanyl-1H-benzimidazol-5-yl]pyrrole-2-carbonitrile

Systemtic Name: 1-[3-(cyclohexylmethyl)-2-oxidanylidene-6-phenylazanyl-1H-benzimidazol-5-yl]pyrrole-2-carbonitrile Openeye Name: 1-[6-anilino-3-(cyclohexylmethyl)-2-oxo-1H-benzimidazol-5-yl]pyrrole-2-carbonitrile CAS Name: 1-[6-anilino-3-(cyclohexylmethyl)-2-oxo-1H-benzimidazol-5-yl]-2-pyrrolecarbonitrile IUPAC Name: 1-[6-anilino-3-(cyclohexylmethyl)-2-oxo-1H-benzimidazol-5-yl]pyrrole-2-carbonitrile Traditional Name: 1-[6-anilino-3-(cyclohexylmethyl)-2-keto-1H-benzimidazol-5-yl]pyrrole-2-carbonitrile Formula: C25H25N5O MolecularWeight: 411.4989

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2C3=CC(=C(C=C3NC2=O)NC4=CC=CC=C4)N5C=CC=C5C#N

Isomeric SMILES

C1CCC(CC1)CN2C3=CC(=C(C=C3NC2=O)NC4=CC=CC=C4)N5C=CC=C5C#N

InChI

InChI=1S/C25H25N5O/c26-16-20-12-7-13-29(20)23-15-24-22(14-21(23)27-19-10-5-2-6-11-19)28-25(31)30(24)17-18-8-3-1-4-9-18/h2,5-7,10-15,18,27H,1,3-4,8-9,17H2,(H,28,31)