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

Systemtic Name: 5-[4-(2,5-dimethylphenyl)piperazin-1-yl]carbonyl-N-methyl-1-(3-methylbutyl)-4-oxidanylidene-pyridine-3-carboxamide Openeye Name: 5-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-1-isopentyl-N-methyl-4-oxo-pyridine-3-carboxamide CAS Name: 5-[[4-(2,5-dimethylphenyl)-1-piperazinyl]-oxomethyl]-N-methyl-1-(3-methylbutyl)-4-oxo-3-pyridinecarboxamide IUPAC Name: 5-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-N-methyl-1-(3-methylbutyl)-4-oxopyridine-3-carboxamide Traditional Name: 5-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-1-isoamyl-4-keto-N-methyl-nicotinamide Formula: C25H34N4O3 MolecularWeight: 438.56246

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H34N4O3/c1-17(2)8-9-27-15-20(24(31)26-5)23(30)21(16-27)25(32)29-12-10-28(11-13-29)22-14-18(3)6-7-19(22)4/h6-7,14-17H,8-13H2,1-5H3,(H,26,31)