2-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-N-naphthalen-2-yl-ethanamide

Systemtic Name: 2-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-N-naphthalen-2-yl-ethanamide Openeye Name: N-(2-naphthyl)-2-[4-(p-tolylsulfonyl)-1,4-diazepan-1-yl]acetamide CAS Name: 2-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-N-(2-naphthalenyl)acetamide IUPAC Name: 2-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-N-naphthalen-2-ylacetamide Traditional Name: N-(2-naphthyl)-2-(4-tosyl-1,4-diazepan-1-yl)acetamide Formula: C24H27N3O3S MolecularWeight: 437.55448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)CC(=O)NC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)CC(=O)NC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C24H27N3O3S/c1-19-7-11-23(12-8-19)31(29,30)27-14-4-13-26(15-16-27)18-24(28)25-22-10-9-20-5-2-3-6-21(20)17-22/h2-3,5-12,17H,4,13-16,18H2,1H3,(H,25,28)