N-(3-methylbutyl)-1-(2-methylpropyl)-5-[4-(6-methylpyridin-1-ium-2-yl)piperazin-1-yl]carbonyl-4-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: N-(3-methylbutyl)-1-(2-methylpropyl)-5-[4-(6-methylpyridin-1-ium-2-yl)piperazin-1-yl]carbonyl-4-oxidanylidene-pyridine-3-carboxamide Openeye Name: 1-isobutyl-N-isopentyl-5-[4-(6-methylpyridin-1-ium-2-yl)piperazine-1-carbonyl]-4-oxo-pyridine-3-carboxamide CAS Name: N-(3-methylbutyl)-1-(2-methylpropyl)-5-[[4-(6-methyl-2-pyridin-1-iumyl)-1-piperazinyl]-oxomethyl]-4-oxo-3-pyridinecarboxamide IUPAC Name: N-(3-methylbutyl)-1-(2-methylpropyl)-5-[4-(6-methylpyridin-1-ium-2-yl)piperazine-1-carbonyl]-4-oxopyridine-3-carboxamide Traditional Name: N-isoamyl-1-isobutyl-4-keto-5-[4-(6-methylpyridin-1-ium-2-yl)piperazine-1-carbonyl]nicotinamide Formula: C26H38N5O3+ MolecularWeight: 468.61162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C(=CC=C1)N2CCN(CC2)C(=O)C3=CN(C=C(C3=O)C(=O)NCCC(C)C)CC(C)C

Isomeric SMILES

CC1=[NH+]C(=CC=C1)N2CCN(CC2)C(=O)C3=CN(C=C(C3=O)C(=O)NCCC(C)C)CC(C)C

InChI

InChI=1S/C26H37N5O3/c1-18(2)9-10-27-25(33)21-16-29(15-19(3)4)17-22(24(21)32)26(34)31-13-11-30(12-14-31)23-8-6-7-20(5)28-23/h6-8,16-19H,9-15H2,1-5H3,(H,27,33)/p+1