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

Systemtic Name: N-(3-methylbutyl)-5-[4-[(3-methylphenyl)methyl]piperazin-1-yl]carbonyl-1-(2-methylpropyl)-4-oxidanylidene-pyridine-3-carboxamide Openeye Name: 1-isobutyl-N-isopentyl-5-[4-(m-tolylmethyl)piperazine-1-carbonyl]-4-oxo-pyridine-3-carboxamide CAS Name: N-(3-methylbutyl)-5-[[4-[(3-methylphenyl)methyl]-1-piperazinyl]-oxomethyl]-1-(2-methylpropyl)-4-oxo-3-pyridinecarboxamide IUPAC Name: N-(3-methylbutyl)-5-[4-[(3-methylphenyl)methyl]piperazine-1-carbonyl]-1-(2-methylpropyl)-4-oxopyridine-3-carboxamide Traditional Name: N-isoamyl-1-isobutyl-4-keto-5-[4-(3-methylbenzyl)piperazine-1-carbonyl]nicotinamide Formula: C28H40N4O3 MolecularWeight: 480.6422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)C3=CN(C=C(C3=O)C(=O)NCCC(C)C)CC(C)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)C3=CN(C=C(C3=O)C(=O)NCCC(C)C)CC(C)C

InChI

InChI=1S/C28H40N4O3/c1-20(2)9-10-29-27(34)24-18-31(16-21(3)4)19-25(26(24)33)28(35)32-13-11-30(12-14-32)17-23-8-6-7-22(5)15-23/h6-8,15,18-21H,9-14,16-17H2,1-5H3,(H,29,34)