2-[2-chloranyl-6-methoxy-4-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]carbonyl]phenoxy]ethanamide

Systemtic Name: 2-[2-chloranyl-6-methoxy-4-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]carbonyl]phenoxy]ethanamide Openeye Name: 2-[2-chloro-6-methoxy-4-[4-(p-tolylsulfonyl)-1,4-diazepane-1-carbonyl]phenoxy]acetamide CAS Name: 2-[2-chloro-6-methoxy-4-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-oxomethyl]phenoxy]acetamide IUPAC Name: 2-[2-chloro-6-methoxy-4-[4-(4-methylphenyl)sulfonyl-1,4-diazepane-1-carbonyl]phenoxy]acetamide Traditional Name: 2-[2-chloro-6-methoxy-4-(4-tosyl-1,4-diazepane-1-carbonyl)phenoxy]acetamide Formula: C22H26ClN3O6S MolecularWeight: 495.97634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)C3=CC(=C(C(=C3)Cl)OCC(=O)N)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C(=O)C3=CC(=C(C(=C3)Cl)OCC(=O)N)OC

InChI

InChI=1S/C22H26ClN3O6S/c1-15-4-6-17(7-5-15)33(29,30)26-9-3-8-25(10-11-26)22(28)16-12-18(23)21(19(13-16)31-2)32-14-20(24)27/h4-7,12-13H,3,8-11,14H2,1-2H3,(H2,24,27)