5-[4-(2-methoxyphenyl)piperazin-1-yl]carbonyl-N-(3-methylbutyl)-1-(2-methylpropyl)-4-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: 5-[4-(2-methoxyphenyl)piperazin-1-yl]carbonyl-N-(3-methylbutyl)-1-(2-methylpropyl)-4-oxidanylidene-pyridine-3-carboxamide Openeye Name: 1-isobutyl-N-isopentyl-5-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-4-oxo-pyridine-3-carboxamide CAS Name: 5-[[4-(2-methoxyphenyl)-1-piperazinyl]-oxomethyl]-N-(3-methylbutyl)-1-(2-methylpropyl)-4-oxo-3-pyridinecarboxamide IUPAC Name: 5-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-N-(3-methylbutyl)-1-(2-methylpropyl)-4-oxopyridine-3-carboxamide Traditional Name: N-isoamyl-1-isobutyl-4-keto-5-[4-(2-methoxyphenyl)piperazine-1-carbonyl]nicotinamide Formula: C27H38N4O4 MolecularWeight: 482.61502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CN(C=C(C1=O)C(=O)N2CCN(CC2)C3=CC=CC=C3OC)CC(C)C

Isomeric SMILES

CC(C)CCNC(=O)C1=CN(C=C(C1=O)C(=O)N2CCN(CC2)C3=CC=CC=C3OC)CC(C)C

InChI

InChI=1S/C27H38N4O4/c1-19(2)10-11-28-26(33)21-17-29(16-20(3)4)18-22(25(21)32)27(34)31-14-12-30(13-15-31)23-8-6-7-9-24(23)35-5/h6-9,17-20H,10-16H2,1-5H3,(H,28,33)