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

Systemtic Name: 5-[4-(2,4-dimethylphenyl)piperazin-1-yl]carbonyl-N-methyl-4-oxidanylidene-1-phenethyl-pyridine-3-carboxamide Openeye Name: 5-[4-(2,4-dimethylphenyl)piperazine-1-carbonyl]-N-methyl-4-oxo-1-phenethyl-pyridine-3-carboxamide CAS Name: 5-[[4-(2,4-dimethylphenyl)-1-piperazinyl]-oxomethyl]-N-methyl-4-oxo-1-phenethyl-3-pyridinecarboxamide IUPAC Name: 5-[4-(2,4-dimethylphenyl)piperazine-1-carbonyl]-N-methyl-4-oxo-1-phenethylpyridine-3-carboxamide Traditional Name: 5-[4-(2,4-dimethylphenyl)piperazine-1-carbonyl]-4-keto-N-methyl-1-phenethyl-nicotinamide Formula: C28H32N4O3 MolecularWeight: 472.57868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CN(C=C(C3=O)C(=O)NC)CCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CN(C=C(C3=O)C(=O)NC)CCC4=CC=CC=C4)C

InChI

InChI=1S/C28H32N4O3/c1-20-9-10-25(21(2)17-20)31-13-15-32(16-14-31)28(35)24-19-30(12-11-22-7-5-4-6-8-22)18-23(26(24)33)27(34)29-3/h4-10,17-19H,11-16H2,1-3H3,(H,29,34)