5-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonyl-N-ethyl-4-oxidanylidene-1-phenethyl-pyridine-3-carboxamide

Systemtic Name: 5-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonyl-N-ethyl-4-oxidanylidene-1-phenethyl-pyridine-3-carboxamide Openeye Name: 5-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-N-ethyl-4-oxo-1-phenethyl-pyridine-3-carboxamide CAS Name: 5-[[4-(2,3-dimethylphenyl)-1-piperazinyl]-oxomethyl]-N-ethyl-4-oxo-1-phenethyl-3-pyridinecarboxamide IUPAC Name: 5-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-N-ethyl-4-oxo-1-phenethylpyridine-3-carboxamide Traditional Name: 5-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-N-ethyl-4-keto-1-phenethyl-nicotinamide Formula: C29H34N4O3 MolecularWeight: 486.60526

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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(=C3C)C)CCC4=CC=CC=C4

Isomeric SMILES

CCNC(=O)C1=CN(C=C(C1=O)C(=O)N2CCN(CC2)C3=CC=CC(=C3C)C)CCC4=CC=CC=C4

InChI

InChI=1S/C29H34N4O3/c1-4-30-28(35)24-19-31(14-13-23-10-6-5-7-11-23)20-25(27(24)34)29(36)33-17-15-32(16-18-33)26-12-8-9-21(2)22(26)3/h5-12,19-20H,4,13-18H2,1-3H3,(H,30,35)