2-[(2-butyl-4-methyl-7-phenylmethoxy-benzimidazol-1-yl)methyl]-6-phenyl-benzenecarbonitrile

Systemtic Name: 2-[(2-butyl-4-methyl-7-phenylmethoxy-benzimidazol-1-yl)methyl]-6-phenyl-benzenecarbonitrile Openeye Name: 2-[(7-benzyloxy-2-butyl-4-methyl-benzimidazol-1-yl)methyl]-6-phenyl-benzonitrile CAS Name: 2-[(2-butyl-4-methyl-7-phenylmethoxy-1-benzimidazolyl)methyl]-6-phenylbenzonitrile IUPAC Name: 2-[(2-butyl-4-methyl-7-phenylmethoxybenzimidazol-1-yl)methyl]-6-phenylbenzonitrile Traditional Name: 2-[(7-benzoxy-2-butyl-4-methyl-benzimidazol-1-yl)methyl]-6-phenyl-benzonitrile Formula: C33H31N3O MolecularWeight: 485.61874

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C=CC(=C2N1CC3=CC=CC(=C3C#N)C4=CC=CC=C4)OCC5=CC=CC=C5)C

Isomeric SMILES

CCCCC1=NC2=C(C=CC(=C2N1CC3=CC=CC(=C3C#N)C4=CC=CC=C4)OCC5=CC=CC=C5)C

InChI

InChI=1S/C33H31N3O/c1-3-4-18-31-35-32-24(2)19-20-30(37-23-25-12-7-5-8-13-25)33(32)36(31)22-27-16-11-17-28(29(27)21-34)26-14-9-6-10-15-26/h5-17,19-20H,3-4,18,22-23H2,1-2H3