3-[3-(2-azanyl-4-cyclopropyl-1-methyl-5-oxidanylidene-imidazol-4-yl)phenyl]benzenecarbonitrile

Systemtic Name: 3-[3-(2-azanyl-4-cyclopropyl-1-methyl-5-oxidanylidene-imidazol-4-yl)phenyl]benzenecarbonitrile Openeye Name: 3-[3-(2-amino-4-cyclopropyl-1-methyl-5-oxo-imidazol-4-yl)phenyl]benzonitrile CAS Name: 3-[3-(2-amino-4-cyclopropyl-1-methyl-5-oxo-4-imidazolyl)phenyl]benzonitrile IUPAC Name: 3-[3-(2-amino-4-cyclopropyl-1-methyl-5-oxoimidazol-4-yl)phenyl]benzonitrile Traditional Name: 3-[3-(2-amino-4-cyclopropyl-5-keto-1-methyl-2-imidazolin-4-yl)phenyl]benzonitrile Formula: C20H18N4O MolecularWeight: 330.38312

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(N=C1N)(C2CC2)C3=CC=CC(=C3)C4=CC=CC(=C4)C#N

Isomeric SMILES

CN1C(=O)C(N=C1N)(C2CC2)C3=CC=CC(=C3)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C20H18N4O/c1-24-18(25)20(16-8-9-16,23-19(24)22)17-7-3-6-15(11-17)14-5-2-4-13(10-14)12-21/h2-7,10-11,16H,8-9H2,1H3,(H2,22,23)