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

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-methyl-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Openeye Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-methyl-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide CAS Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-methyl-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide IUPAC Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-methyl-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Traditional Name: 4-keto-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-methyl-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Formula: C18H17N3O4S3 MolecularWeight: 435.54028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=C(S1)C=CC(=C2)S(=O)(=O)NC3=NC4=C(S3)C=C(C=C4)OC

Isomeric SMILES

CC1CC(=O)NC2=C(S1)C=CC(=C2)S(=O)(=O)NC3=NC4=C(S3)C=C(C=C4)OC

InChI

InChI=1S/C18H17N3O4S3/c1-10-7-17(22)19-14-9-12(4-6-15(14)26-10)28(23,24)21-18-20-13-5-3-11(25-2)8-16(13)27-18/h3-6,8-10H,7H2,1-2H3,(H,19,22)(H,20,21)