(E)-5-oxidanylidene-5-phenyl-3-piperidin-1-yl-2-thiophen-3-yl-pent-3-enenitrile

Systemtic Name: (E)-5-oxidanylidene-5-phenyl-3-piperidin-1-yl-2-thiophen-3-yl-pent-3-enenitrile Openeye Name: (E)-5-oxo-5-phenyl-3-(1-piperidyl)-2-(3-thienyl)pent-3-enenitrile CAS Name: (E)-5-oxo-5-phenyl-3-(1-piperidinyl)-2-(3-thiophenyl)-3-pentenenitrile IUPAC Name: (E)-5-oxo-5-phenyl-3-piperidin-1-yl-2-thiophen-3-ylpent-3-enenitrile Traditional Name: (E)-5-keto-5-phenyl-3-piperidino-2-(3-thienyl)pent-3-enenitrile Formula: C20H20N2OS MolecularWeight: 336.4506

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=CC(=O)C2=CC=CC=C2)C(C#N)C3=CSC=C3

Isomeric SMILES

C1CCN(CC1)/C(=C/C(=O)C2=CC=CC=C2)/C(C#N)C3=CSC=C3

InChI

InChI=1S/C20H20N2OS/c21-14-18(17-9-12-24-15-17)19(22-10-5-2-6-11-22)13-20(23)16-7-3-1-4-8-16/h1,3-4,7-9,12-13,15,18H,2,5-6,10-11H2/b19-13+