N-[2-(4-cyclopentylpiperazin-1-yl)pyridin-4-yl]azepane-1-carboxamide

Systemtic Name: N-[2-(4-cyclopentylpiperazin-1-yl)pyridin-4-yl]azepane-1-carboxamide Openeye Name: N-[2-(4-cyclopentylpiperazin-1-yl)-4-pyridyl]azepane-1-carboxamide CAS Name: N-[2-(4-cyclopentyl-1-piperazinyl)-4-pyridinyl]-1-azepanecarboxamide IUPAC Name: N-[2-(4-cyclopentylpiperazin-1-yl)pyridin-4-yl]azepane-1-carboxamide Traditional Name: N-[2-(4-cyclopentylpiperazino)-4-pyridyl]azepane-1-carboxamide Formula: C21H33N5O MolecularWeight: 371.51962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)NC2=CC(=NC=C2)N3CCN(CC3)C4CCCC4

Isomeric SMILES

C1CCCN(CC1)C(=O)NC2=CC(=NC=C2)N3CCN(CC3)C4CCCC4

InChI

InChI=1S/C21H33N5O/c27-21(26-11-5-1-2-6-12-26)23-18-9-10-22-20(17-18)25-15-13-24(14-16-25)19-7-3-4-8-19/h9-10,17,19H,1-8,11-16H2,(H,22,23,27)