N-[3-(azepan-1-yl)propyl]-2-[(2-methoxy-5-methyl-phenyl)-(phenylsulfonyl)amino]ethanamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-2-[(2-methoxy-5-methyl-phenyl)-(phenylsulfonyl)amino]ethanamide Openeye Name: N-[3-(azepan-1-yl)propyl]-2-[N-(benzenesulfonyl)-2-methoxy-5-methyl-anilino]acetamide CAS Name: N-[3-(1-azepanyl)propyl]-2-[N-(benzenesulfonyl)-2-methoxy-5-methylanilino]acetamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-2-[N-(benzenesulfonyl)-2-methoxy-5-methylanilino]acetamide Traditional Name: N-[3-(azepan-1-yl)propyl]-2-(N-besyl-2-methoxy-5-methyl-anilino)acetamide Formula: C25H35N3O4S MolecularWeight: 473.6281

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)N(CC(=O)NCCCN2CCCCCC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)N(CC(=O)NCCCN2CCCCCC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H35N3O4S/c1-21-13-14-24(32-2)23(19-21)28(33(30,31)22-11-6-5-7-12-22)20-25(29)26-15-10-18-27-16-8-3-4-9-17-27/h5-7,11-14,19H,3-4,8-10,15-18,20H2,1-2H3,(H,26,29)