N-cyclopentyl-5-[4-[(3-fluorophenyl)methyl]piperazin-1-yl]carbonyl-1-(3-methylbutyl)-4-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: N-cyclopentyl-5-[4-[(3-fluorophenyl)methyl]piperazin-1-yl]carbonyl-1-(3-methylbutyl)-4-oxidanylidene-pyridine-3-carboxamide Openeye Name: N-cyclopentyl-5-[4-[(3-fluorophenyl)methyl]piperazine-1-carbonyl]-1-isopentyl-4-oxo-pyridine-3-carboxamide CAS Name: N-cyclopentyl-5-[[4-[(3-fluorophenyl)methyl]-1-piperazinyl]-oxomethyl]-1-(3-methylbutyl)-4-oxo-3-pyridinecarboxamide IUPAC Name: N-cyclopentyl-5-[4-[(3-fluorophenyl)methyl]piperazine-1-carbonyl]-1-(3-methylbutyl)-4-oxopyridine-3-carboxamide Traditional Name: N-cyclopentyl-5-[4-(3-fluorobenzyl)piperazine-1-carbonyl]-1-isoamyl-4-keto-nicotinamide Formula: C28H37FN4O3 MolecularWeight: 496.616783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C=C(C(=O)C(=C1)C(=O)N2CCN(CC2)CC3=CC(=CC=C3)F)C(=O)NC4CCCC4

Isomeric SMILES

CC(C)CCN1C=C(C(=O)C(=C1)C(=O)N2CCN(CC2)CC3=CC(=CC=C3)F)C(=O)NC4CCCC4

InChI

InChI=1S/C28H37FN4O3/c1-20(2)10-11-32-18-24(27(35)30-23-8-3-4-9-23)26(34)25(19-32)28(36)33-14-12-31(13-15-33)17-21-6-5-7-22(29)16-21/h5-7,16,18-20,23H,3-4,8-15,17H2,1-2H3,(H,30,35)