1-[2-[2-oxidanylidene-5-(1-phenylbenzimidazol-5-yl)pyrimidin-1-yl]ethyl]piperidine-4-carbonitrile

Systemtic Name: 1-[2-[2-oxidanylidene-5-(1-phenylbenzimidazol-5-yl)pyrimidin-1-yl]ethyl]piperidine-4-carbonitrile Openeye Name: 1-[2-[2-oxo-5-(1-phenylbenzimidazol-5-yl)pyrimidin-1-yl]ethyl]piperidine-4-carbonitrile CAS Name: 1-[2-[2-oxo-5-(1-phenyl-5-benzimidazolyl)-1-pyrimidinyl]ethyl]-4-piperidinecarbonitrile IUPAC Name: 1-[2-[2-oxo-5-(1-phenylbenzimidazol-5-yl)pyrimidin-1-yl]ethyl]piperidine-4-carbonitrile Traditional Name: 1-[2-[2-keto-5-(1-phenylbenzimidazol-5-yl)pyrimidin-1-yl]ethyl]isonipecotonitrile Formula: C25H24N6O MolecularWeight: 424.49766

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C#N)CCN2C=C(C=NC2=O)C3=CC4=C(C=C3)N(C=N4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C#N)CCN2C=C(C=NC2=O)C3=CC4=C(C=C3)N(C=N4)C5=CC=CC=C5

InChI

InChI=1S/C25H24N6O/c26-15-19-8-10-29(11-9-19)12-13-30-17-21(16-27-25(30)32)20-6-7-24-23(14-20)28-18-31(24)22-4-2-1-3-5-22/h1-7,14,16-19H,8-13H2