N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(4-pyridin-2-ylpiperazin-1-yl)ethanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(4-pyridin-2-ylpiperazin-1-yl)ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[4-(2-pyridyl)piperazin-1-yl]acetamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-2-[4-(2-pyridinyl)-1-piperazinyl]acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[4-(2-pyridyl)piperazino]acetamide Formula: C23H31N5O3S MolecularWeight: 457.58894

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CN3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CN3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C23H31N5O3S/c29-23(19-26-14-16-27(17-15-26)22-10-3-4-11-24-22)25-20-8-7-9-21(18-20)32(30,31)28-12-5-1-2-6-13-28/h3-4,7-11,18H,1-2,5-6,12-17,19H2,(H,25,29)