2,5-dimethyl-4-[4-(phenylsulfonyl)piperazin-1-yl]carbonyl-furan-3-sulfonamide

Systemtic Name: 2,5-dimethyl-4-[4-(phenylsulfonyl)piperazin-1-yl]carbonyl-furan-3-sulfonamide Openeye Name: 4-[4-(benzenesulfonyl)piperazine-1-carbonyl]-2,5-dimethyl-furan-3-sulfonamide CAS Name: 4-[[4-(benzenesulfonyl)-1-piperazinyl]-oxomethyl]-2,5-dimethyl-3-furansulfonamide IUPAC Name: 4-[4-(benzenesulfonyl)piperazine-1-carbonyl]-2,5-dimethylfuran-3-sulfonamide Traditional Name: 4-(4-besylpiperazine-1-carbonyl)-2,5-dimethyl-furan-3-sulfonamide Formula: C17H21N3O6S2 MolecularWeight: 427.49514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(O1)C)S(=O)(=O)N)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=C(O1)C)S(=O)(=O)N)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H21N3O6S2/c1-12-15(16(13(2)26-12)27(18,22)23)17(21)19-8-10-20(11-9-19)28(24,25)14-6-4-3-5-7-14/h3-7H,8-11H2,1-2H3,(H2,18,22,23)