3-[4-[(4-phenyl-1H-imidazol-5-yl)carbonyl]piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 3-[4-[(4-phenyl-1H-imidazol-5-yl)carbonyl]piperazin-1-yl]benzenecarbonitrile Openeye Name: 3-[4-(4-phenyl-1H-imidazole-5-carbonyl)piperazin-1-yl]benzonitrile CAS Name: 3-[4-[oxo-(4-phenyl-1H-imidazol-5-yl)methyl]-1-piperazinyl]benzonitrile IUPAC Name: 3-[4-(4-phenyl-1H-imidazole-5-carbonyl)piperazin-1-yl]benzonitrile Traditional Name: 3-[4-(4-phenyl-1H-imidazole-5-carbonyl)piperazino]benzonitrile Formula: C21H19N5O MolecularWeight: 357.40846

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC(=C2)C#N)C(=O)C3=C(N=CN3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)C#N)C(=O)C3=C(N=CN3)C4=CC=CC=C4

InChI

InChI=1S/C21H19N5O/c22-14-16-5-4-8-18(13-16)25-9-11-26(12-10-25)21(27)20-19(23-15-24-20)17-6-2-1-3-7-17/h1-8,13,15H,9-12H2,(H,23,24)