N-(2-methyl-1,3-benzothiazol-6-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-(2-methyl-1,3-benzothiazol-6-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-(2-methyl-1,3-benzothiazol-6-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-(2-methyl-1,3-benzothiazol-6-yl)-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-(2-methyl-1,3-benzothiazol-6-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-(2-methyl-1,3-benzothiazol-6-yl)-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C17H16N2O4S2 MolecularWeight: 376.44994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C17H16N2O4S2/c1-11-18-14-5-3-12(9-17(14)24-11)19-25(20,21)13-4-6-15-16(10-13)23-8-2-7-22-15/h3-6,9-10,19H,2,7-8H2,1H3