N-(3-azanylpropyl)-4-cyano-N-[(1R)-2-methyl-1-[1-(phenylmethyl)benzimidazol-2-yl]propyl]benzamide

Systemtic Name: N-(3-azanylpropyl)-4-cyano-N-[(1R)-2-methyl-1-[1-(phenylmethyl)benzimidazol-2-yl]propyl]benzamide Openeye Name: N-(3-aminopropyl)-N-[(1R)-1-(1-benzylbenzimidazol-2-yl)-2-methyl-propyl]-4-cyano-benzamide CAS Name: N-(3-aminopropyl)-4-cyano-N-[(1R)-2-methyl-1-[1-(phenylmethyl)-2-benzimidazolyl]propyl]benzamide IUPAC Name: N-(3-aminopropyl)-N-[(1R)-1-(1-benzylbenzimidazol-2-yl)-2-methylpropyl]-4-cyanobenzamide Traditional Name: N-(3-aminopropyl)-N-[(1R)-1-(1-benzylbenzimidazol-2-yl)-2-methyl-propyl]-4-cyano-benzamide Formula: C29H31N5O MolecularWeight: 465.58934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=NC2=CC=CC=C2N1CC3=CC=CC=C3)N(CCCN)C(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

CC(C)[C@H](C1=NC2=CC=CC=C2N1CC3=CC=CC=C3)N(CCCN)C(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C29H31N5O/c1-21(2)27(33(18-8-17-30)29(35)24-15-13-22(19-31)14-16-24)28-32-25-11-6-7-12-26(25)34(28)20-23-9-4-3-5-10-23/h3-7,9-16,21,27H,8,17-18,20,30H2,1-2H3/t27-/m1/s1