N-ethyl-4-oxidanylidene-1-(phenylmethyl)-5-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]carbonyl-pyridine-3-carboxamide

Systemtic Name: N-ethyl-4-oxidanylidene-1-(phenylmethyl)-5-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]carbonyl-pyridine-3-carboxamide Openeye Name: 1-benzyl-5-[4-[(E)-cinnamyl]piperazine-1-carbonyl]-N-ethyl-4-oxo-pyridine-3-carboxamide CAS Name: N-ethyl-4-oxo-5-[oxo-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]methyl]-1-(phenylmethyl)-3-pyridinecarboxamide IUPAC Name: 1-benzyl-N-ethyl-4-oxo-5-[4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbonyl]pyridine-3-carboxamide Traditional Name: 1-benzyl-5-[4-[(E)-cinnamyl]piperazine-1-carbonyl]-N-ethyl-4-keto-nicotinamide Formula: C29H32N4O3 MolecularWeight: 484.58938

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CN(C=C(C1=O)C(=O)N2CCN(CC2)CC=CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCNC(=O)C1=CN(C=C(C1=O)C(=O)N2CCN(CC2)C/C=C/C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C29H32N4O3/c1-2-30-28(35)25-21-32(20-24-12-7-4-8-13-24)22-26(27(25)34)29(36)33-18-16-31(17-19-33)15-9-14-23-10-5-3-6-11-23/h3-14,21-22H,2,15-20H2,1H3,(H,30,35)/b14-9+