1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-2-(4-methylphenyl)ethanone

Systemtic Name: 1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-2-(4-methylphenyl)ethanone Openeye Name: 1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-2-(p-tolyl)ethanone CAS Name: 1-[4-(1-azepanylsulfonyl)-1-piperazinyl]-2-(4-methylphenyl)ethanone IUPAC Name: 1-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-2-(4-methylphenyl)ethanone Traditional Name: 1-[4-(azepan-1-ylsulfonyl)piperazino]-2-(p-tolyl)ethanone Formula: C19H29N3O3S MolecularWeight: 379.51686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(=O)N2CCN(CC2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)CC(=O)N2CCN(CC2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C19H29N3O3S/c1-17-6-8-18(9-7-17)16-19(23)20-12-14-22(15-13-20)26(24,25)21-10-4-2-3-5-11-21/h6-9H,2-5,10-16H2,1H3