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

Systemtic Name: 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Openeye Name: 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide CAS Name: 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide IUPAC Name: 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Traditional Name: 4-keto-2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Formula: C18H17N3O3S3 MolecularWeight: 419.54088

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3O3S3/c1-10-3-5-13-16(7-10)26-18(20-13)21-27(23,24)12-4-6-15-14(9-12)19-17(22)8-11(2)25-15/h3-7,9,11H,8H2,1-2H3,(H,19,22)(H,20,21)