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

Systemtic Name: 6-[4-(2-ethylbutanoyl)piperazin-1-yl]-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide Openeye Name: 6-[4-(2-ethylbutanoyl)piperazin-1-yl]-N-(tetrahydrofuran-2-ylmethyl)pyridine-3-carboxamide CAS Name: 6-[4-(2-ethyl-1-oxobutyl)-1-piperazinyl]-N-(2-oxolanylmethyl)-3-pyridinecarboxamide IUPAC Name: 6-[4-(2-ethylbutanoyl)piperazin-1-yl]-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide Traditional Name: 6-[4-(2-ethylbutanoyl)piperazino]-N-(tetrahydrofurfuryl)nicotinamide Formula: C21H32N4O3 MolecularWeight: 388.50378

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)N1CCN(CC1)C2=NC=C(C=C2)C(=O)NCC3CCCO3

Isomeric SMILES

CCC(CC)C(=O)N1CCN(CC1)C2=NC=C(C=C2)C(=O)NCC3CCCO3

InChI

InChI=1S/C21H32N4O3/c1-3-16(4-2)21(27)25-11-9-24(10-12-25)19-8-7-17(14-22-19)20(26)23-15-18-6-5-13-28-18/h7-8,14,16,18H,3-6,9-13,15H2,1-2H3,(H,23,26)