1-(4-azanylcyclohexyl)-3-[(3-chloranyl-4-methoxy-phenyl)methyl]-2-oxidanylidene-benzimidazole-5-carbonitrile

Systemtic Name: 1-(4-azanylcyclohexyl)-3-[(3-chloranyl-4-methoxy-phenyl)methyl]-2-oxidanylidene-benzimidazole-5-carbonitrile Openeye Name: 1-(4-aminocyclohexyl)-3-[(3-chloro-4-methoxy-phenyl)methyl]-2-oxo-benzimidazole-5-carbonitrile CAS Name: 1-(4-aminocyclohexyl)-3-[(3-chloro-4-methoxyphenyl)methyl]-2-oxo-5-benzimidazolecarbonitrile IUPAC Name: 1-(4-aminocyclohexyl)-3-[(3-chloro-4-methoxyphenyl)methyl]-2-oxobenzimidazole-5-carbonitrile Traditional Name: 1-(4-aminocyclohexyl)-3-(3-chloro-4-methoxy-benzyl)-2-keto-benzimidazole-5-carbonitrile Formula: C22H23ClN4O2 MolecularWeight: 410.89662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C3=C(C=CC(=C3)C#N)N(C2=O)C4CCC(CC4)N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C3=C(C=CC(=C3)C#N)N(C2=O)C4CCC(CC4)N)Cl

InChI

InChI=1S/C22H23ClN4O2/c1-29-21-9-3-15(10-18(21)23)13-26-20-11-14(12-24)2-8-19(20)27(22(26)28)17-6-4-16(25)5-7-17/h2-3,8-11,16-17H,4-7,13,25H2,1H3