N-(oxolan-2-ylmethyl)-2-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-cyclohexane-1-carboxamide

Systemtic Name: N-(oxolan-2-ylmethyl)-2-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-cyclohexane-1-carboxamide Openeye Name: 2-[4-(2-pyridyl)piperazine-1-carbonyl]-N-(tetrahydrofuran-2-ylmethyl)cyclohexanecarboxamide CAS Name: N-(2-oxolanylmethyl)-2-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]-1-cyclohexanecarboxamide IUPAC Name: N-(oxolan-2-ylmethyl)-2-(4-pyridin-2-ylpiperazine-1-carbonyl)cyclohexane-1-carboxamide Traditional Name: 2-[4-(2-pyridyl)piperazine-1-carbonyl]-N-(tetrahydrofurfuryl)cyclohexanecarboxamide Formula: C22H32N4O3 MolecularWeight: 400.51448

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NCC2CCCO2)C(=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

C1CCC(C(C1)C(=O)NCC2CCCO2)C(=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C22H32N4O3/c27-21(24-16-17-6-5-15-29-17)18-7-1-2-8-19(18)22(28)26-13-11-25(12-14-26)20-9-3-4-10-23-20/h3-4,9-10,17-19H,1-2,5-8,11-16H2,(H,24,27)