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

Systemtic Name: 1-(3-methylbutyl)-N-(2-methylpropyl)-4-oxidanylidene-5-[4-(thiophen-2-ylmethyl)piperazin-1-yl]carbonyl-pyridine-3-carboxamide Openeye Name: N-isobutyl-1-isopentyl-4-oxo-5-[4-(2-thienylmethyl)piperazine-1-carbonyl]pyridine-3-carboxamide CAS Name: 1-(3-methylbutyl)-N-(2-methylpropyl)-4-oxo-5-[oxo-[4-(thiophen-2-ylmethyl)-1-piperazinyl]methyl]-3-pyridinecarboxamide IUPAC Name: 1-(3-methylbutyl)-N-(2-methylpropyl)-4-oxo-5-[4-(thiophen-2-ylmethyl)piperazine-1-carbonyl]pyridine-3-carboxamide Traditional Name: 1-isoamyl-N-isobutyl-4-keto-5-[4-(2-thenyl)piperazine-1-carbonyl]nicotinamide Formula: C25H36N4O3S MolecularWeight: 472.64334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C=C(C(=O)C(=C1)C(=O)N2CCN(CC2)CC3=CC=CS3)C(=O)NCC(C)C

Isomeric SMILES

CC(C)CCN1C=C(C(=O)C(=C1)C(=O)N2CCN(CC2)CC3=CC=CS3)C(=O)NCC(C)C

InChI

InChI=1S/C25H36N4O3S/c1-18(2)7-8-28-16-21(24(31)26-14-19(3)4)23(30)22(17-28)25(32)29-11-9-27(10-12-29)15-20-6-5-13-33-20/h5-6,13,16-19H,7-12,14-15H2,1-4H3,(H,26,31)