N-[3-(azepan-1-yl)propyl]-2-[(2-methylphenyl)-(phenylsulfonyl)amino]ethanamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-2-[(2-methylphenyl)-(phenylsulfonyl)amino]ethanamide Openeye Name: N-[3-(azepan-1-yl)propyl]-2-[N-(benzenesulfonyl)-2-methyl-anilino]acetamide CAS Name: N-[3-(1-azepanyl)propyl]-2-[N-(benzenesulfonyl)-2-methylanilino]acetamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-2-[N-(benzenesulfonyl)-2-methylanilino]acetamide Traditional Name: N-[3-(azepan-1-yl)propyl]-2-(N-besyl-2-methyl-anilino)acetamide Formula: C24H33N3O3S MolecularWeight: 443.60212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(CC(=O)NCCCN2CCCCCC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1N(CC(=O)NCCCN2CCCCCC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H33N3O3S/c1-21-12-7-8-15-23(21)27(31(29,30)22-13-5-4-6-14-22)20-24(28)25-16-11-19-26-17-9-2-3-10-18-26/h4-8,12-15H,2-3,9-11,16-20H2,1H3,(H,25,28)