N-(2-methoxyphenyl)-4-[(4-methylsulfonyl-1,4-diazepan-1-yl)carbonyl]benzenesulfonamide

Systemtic Name: N-(2-methoxyphenyl)-4-[(4-methylsulfonyl-1,4-diazepan-1-yl)carbonyl]benzenesulfonamide Openeye Name: N-(2-methoxyphenyl)-4-(4-methylsulfonyl-1,4-diazepane-1-carbonyl)benzenesulfonamide CAS Name: N-(2-methoxyphenyl)-4-[(4-methylsulfonyl-1,4-diazepan-1-yl)-oxomethyl]benzenesulfonamide IUPAC Name: N-(2-methoxyphenyl)-4-(4-methylsulfonyl-1,4-diazepane-1-carbonyl)benzenesulfonamide Traditional Name: 4-(4-mesyl-1,4-diazepane-1-carbonyl)-N-(2-methoxyphenyl)benzenesulfonamide Formula: C20H25N3O6S2 MolecularWeight: 467.559

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCCN(CC3)S(=O)(=O)C

Isomeric SMILES

COC1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C20H25N3O6S2/c1-29-19-7-4-3-6-18(19)21-31(27,28)17-10-8-16(9-11-17)20(24)22-12-5-13-23(15-14-22)30(2,25)26/h3-4,6-11,21H,5,12-15H2,1-2H3