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

Systemtic Name: 2-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-N-naphthalen-1-yl-ethanamide Openeye Name: N-(1-naphthyl)-2-[4-(p-tolylsulfonyl)-1,4-diazepan-1-yl]acetamide CAS Name: 2-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-N-(1-naphthalenyl)acetamide IUPAC Name: 2-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-N-naphthalen-1-ylacetamide Traditional Name: N-(1-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=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)CC(=O)NC3=CC=CC4=CC=CC=C43

InChI

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