N-[[2-(4-pyridin-2-ylpiperazin-1-yl)pyridin-3-yl]methyl]cyclohex-3-ene-1-carboxamide

Systemtic Name: N-[[2-(4-pyridin-2-ylpiperazin-1-yl)pyridin-3-yl]methyl]cyclohex-3-ene-1-carboxamide Openeye Name: N-[[2-[4-(2-pyridyl)piperazin-1-yl]-3-pyridyl]methyl]cyclohex-3-ene-1-carboxamide CAS Name: N-[[2-[4-(2-pyridinyl)-1-piperazinyl]-3-pyridinyl]methyl]-1-cyclohex-3-enecarboxamide IUPAC Name: N-[[2-(4-pyridin-2-ylpiperazin-1-yl)pyridin-3-yl]methyl]cyclohex-3-ene-1-carboxamide Traditional Name: N-[[2-[4-(2-pyridyl)piperazino]-3-pyridyl]methyl]cyclohex-3-ene-1-carboxamide Formula: C22H27N5O MolecularWeight: 377.48268

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)C(=O)NCC2=C(N=CC=C2)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

C1CC(CC=C1)C(=O)NCC2=C(N=CC=C2)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C22H27N5O/c28-22(18-7-2-1-3-8-18)25-17-19-9-6-12-24-21(19)27-15-13-26(14-16-27)20-10-4-5-11-23-20/h1-2,4-6,9-12,18H,3,7-8,13-17H2,(H,25,28)