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

Systemtic Name: 5-[4-(2-ethoxyphenyl)piperazin-1-yl]carbonyl-N-ethyl-4-oxidanylidene-1-(phenylmethyl)pyridine-3-carboxamide Openeye Name: 1-benzyl-5-[4-(2-ethoxyphenyl)piperazine-1-carbonyl]-N-ethyl-4-oxo-pyridine-3-carboxamide CAS Name: 5-[[4-(2-ethoxyphenyl)-1-piperazinyl]-oxomethyl]-N-ethyl-4-oxo-1-(phenylmethyl)-3-pyridinecarboxamide IUPAC Name: 1-benzyl-5-[4-(2-ethoxyphenyl)piperazine-1-carbonyl]-N-ethyl-4-oxopyridine-3-carboxamide Traditional Name: 1-benzyl-N-ethyl-4-keto-5-(4-o-phenetylpiperazine-1-carbonyl)nicotinamide Formula: C28H32N4O4 MolecularWeight: 488.57808

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CN(C=C(C1=O)C(=O)N2CCN(CC2)C3=CC=CC=C3OCC)CC4=CC=CC=C4

Isomeric SMILES

CCNC(=O)C1=CN(C=C(C1=O)C(=O)N2CCN(CC2)C3=CC=CC=C3OCC)CC4=CC=CC=C4

InChI

InChI=1S/C28H32N4O4/c1-3-29-27(34)22-19-30(18-21-10-6-5-7-11-21)20-23(26(22)33)28(35)32-16-14-31(15-17-32)24-12-8-9-13-25(24)36-4-2/h5-13,19-20H,3-4,14-18H2,1-2H3,(H,29,34)