1-[2-[2-oxidanylidene-5-(1-thiophen-3-ylbenzimidazol-5-yl)pyridin-1-yl]ethyl]piperidine-4-carbonitrile

Systemtic Name: 1-[2-[2-oxidanylidene-5-(1-thiophen-3-ylbenzimidazol-5-yl)pyridin-1-yl]ethyl]piperidine-4-carbonitrile Openeye Name: 1-[2-[2-oxo-5-[1-(3-thienyl)benzimidazol-5-yl]-1-pyridyl]ethyl]piperidine-4-carbonitrile CAS Name: 1-[2-[2-oxo-5-[1-(3-thiophenyl)-5-benzimidazolyl]-1-pyridinyl]ethyl]-4-piperidinecarbonitrile IUPAC Name: 1-[2-[2-oxo-5-(1-thiophen-3-ylbenzimidazol-5-yl)pyridin-1-yl]ethyl]piperidine-4-carbonitrile Traditional Name: 1-[2-[2-keto-5-[1-(3-thienyl)benzimidazol-5-yl]-1-pyridyl]ethyl]isonipecotonitrile Formula: C24H23N5OS MolecularWeight: 429.53732

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C#N)CCN2C=C(C=CC2=O)C3=CC4=C(C=C3)N(C=N4)C5=CSC=C5

Isomeric SMILES

C1CN(CCC1C#N)CCN2C=C(C=CC2=O)C3=CC4=C(C=C3)N(C=N4)C5=CSC=C5

InChI

InChI=1S/C24H23N5OS/c25-14-18-5-8-27(9-6-18)10-11-28-15-20(2-4-24(28)30)19-1-3-23-22(13-19)26-17-29(23)21-7-12-31-16-21/h1-4,7,12-13,15-18H,5-6,8-11H2