6-[4-(2-ethylbutanoyl)piperazin-1-yl]-N-(4-methylpentan-2-yl)pyridine-3-carboxamide

Systemtic Name: 6-[4-(2-ethylbutanoyl)piperazin-1-yl]-N-(4-methylpentan-2-yl)pyridine-3-carboxamide Openeye Name: N-(1,3-dimethylbutyl)-6-[4-(2-ethylbutanoyl)piperazin-1-yl]pyridine-3-carboxamide CAS Name: 6-[4-(2-ethyl-1-oxobutyl)-1-piperazinyl]-N-(4-methylpentan-2-yl)-3-pyridinecarboxamide IUPAC Name: 6-[4-(2-ethylbutanoyl)piperazin-1-yl]-N-(4-methylpentan-2-yl)pyridine-3-carboxamide Traditional Name: N-(1,3-dimethylbutyl)-6-[4-(2-ethylbutanoyl)piperazino]nicotinamide Formula: C22H36N4O2 MolecularWeight: 388.54684

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)N1CCN(CC1)C2=NC=C(C=C2)C(=O)NC(C)CC(C)C

Isomeric SMILES

CCC(CC)C(=O)N1CCN(CC1)C2=NC=C(C=C2)C(=O)NC(C)CC(C)C

InChI

InChI=1S/C22H36N4O2/c1-6-18(7-2)22(28)26-12-10-25(11-13-26)20-9-8-19(15-23-20)21(27)24-17(5)14-16(3)4/h8-9,15-18H,6-7,10-14H2,1-5H3,(H,24,27)