N-[1,1-bis(oxidanylidene)thiolan-3-yl]-4-[(4-methylsulfonyl-1,4-diazepan-1-yl)carbonyl]benzenesulfonamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-4-[(4-methylsulfonyl-1,4-diazepan-1-yl)carbonyl]benzenesulfonamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-4-(4-methylsulfonyl-1,4-diazepane-1-carbonyl)benzenesulfonamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-4-[(4-methylsulfonyl-1,4-diazepan-1-yl)-oxomethyl]benzenesulfonamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-4-(4-methylsulfonyl-1,4-diazepane-1-carbonyl)benzenesulfonamide Traditional Name: N-(1,1-diketothiolan-3-yl)-4-(4-mesyl-1,4-diazepane-1-carbonyl)benzenesulfonamide Formula: C17H25N3O7S3 MolecularWeight: 479.5913

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCN(CC1)C(=O)C2=CC=C(C=C2)S(=O)(=O)NC3CCS(=O)(=O)C3

Isomeric SMILES

CS(=O)(=O)N1CCCN(CC1)C(=O)C2=CC=C(C=C2)S(=O)(=O)NC3CCS(=O)(=O)C3

InChI

InChI=1S/C17H25N3O7S3/c1-28(22,23)20-9-2-8-19(10-11-20)17(21)14-3-5-16(6-4-14)30(26,27)18-15-7-12-29(24,25)13-15/h3-6,15,18H,2,7-13H2,1H3