5-[(2-butyl-4,4-dimethyl-5-oxidanylidene-imidazol-1-yl)methyl]-2-phenyl-benzenecarbonitrile

Systemtic Name: 5-[(2-butyl-4,4-dimethyl-5-oxidanylidene-imidazol-1-yl)methyl]-2-phenyl-benzenecarbonitrile Openeye Name: 5-[(2-butyl-4,4-dimethyl-5-oxo-imidazol-1-yl)methyl]-2-phenyl-benzonitrile CAS Name: 5-[(2-butyl-4,4-dimethyl-5-oxo-1-imidazolyl)methyl]-2-phenylbenzonitrile IUPAC Name: 5-[(2-butyl-4,4-dimethyl-5-oxoimidazol-1-yl)methyl]-2-phenylbenzonitrile Traditional Name: 5-[(2-butyl-5-keto-4,4-dimethyl-2-imidazolin-1-yl)methyl]-2-phenyl-benzonitrile Formula: C23H25N3O MolecularWeight: 359.4641

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(C(=O)N1CC2=CC(=C(C=C2)C3=CC=CC=C3)C#N)(C)C

Isomeric SMILES

CCCCC1=NC(C(=O)N1CC2=CC(=C(C=C2)C3=CC=CC=C3)C#N)(C)C

InChI

InChI=1S/C23H25N3O/c1-4-5-11-21-25-23(2,3)22(27)26(21)16-17-12-13-20(19(14-17)15-24)18-9-7-6-8-10-18/h6-10,12-14H,4-5,11,16H2,1-3H3