N-[2-[4-[cyano(pyridin-4-yl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]-2,2-diphenyl-ethanamide

Systemtic Name: N-[2-[4-[cyano(pyridin-4-yl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]-2,2-diphenyl-ethanamide Openeye Name: N-[2-[4-[cyano(4-pyridyl)methyl]piperazin-1-yl]-2-oxo-ethyl]-2,2-diphenyl-acetamide CAS Name: N-[2-[4-[cyano(pyridin-4-yl)methyl]-1-piperazinyl]-2-oxoethyl]-2,2-diphenylacetamide IUPAC Name: N-[2-[4-[cyano(pyridin-4-yl)methyl]piperazin-1-yl]-2-oxoethyl]-2,2-diphenylacetamide Traditional Name: N-[2-[4-[cyano(4-pyridyl)methyl]piperazino]-2-keto-ethyl]-2,2-diphenyl-acetamide Formula: C27H27N5O2 MolecularWeight: 453.53558

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C#N)C2=CC=NC=C2)C(=O)CNC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(C#N)C2=CC=NC=C2)C(=O)CNC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H27N5O2/c28-19-24(21-11-13-29-14-12-21)31-15-17-32(18-16-31)25(33)20-30-27(34)26(22-7-3-1-4-8-22)23-9-5-2-6-10-23/h1-14,24,26H,15-18,20H2,(H,30,34)