N-[2-[4-[cyano(pyridin-3-yl)methyl]piperazin-1-yl]ethyl]-3,3-diphenyl-propanamide

Systemtic Name: N-[2-[4-[cyano(pyridin-3-yl)methyl]piperazin-1-yl]ethyl]-3,3-diphenyl-propanamide Openeye Name: N-[2-[4-[cyano(3-pyridyl)methyl]piperazin-1-yl]ethyl]-3,3-diphenyl-propanamide CAS Name: N-[2-[4-[cyano(3-pyridinyl)methyl]-1-piperazinyl]ethyl]-3,3-diphenylpropanamide IUPAC Name: N-[2-[4-[cyano(pyridin-3-yl)methyl]piperazin-1-yl]ethyl]-3,3-diphenylpropanamide Traditional Name: N-[2-[4-[cyano(3-pyridyl)methyl]piperazino]ethyl]-3,3-diphenyl-propionamide Formula: C28H31N5O MolecularWeight: 453.57864

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3)C(C#N)C4=CN=CC=C4

Isomeric SMILES

C1CN(CCN1CCNC(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3)C(C#N)C4=CN=CC=C4

InChI

InChI=1S/C28H31N5O/c29-21-27(25-12-7-13-30-22-25)33-18-16-32(17-19-33)15-14-31-28(34)20-26(23-8-3-1-4-9-23)24-10-5-2-6-11-24/h1-13,22,26-27H,14-20H2,(H,31,34)