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

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-2-methyl-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-methyl-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-methyl-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-methyl-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-4-keto-2-methyl-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Formula: C17H14ClN3O3S3 MolecularWeight: 439.95936

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C17H14ClN3O3S3/c1-9-6-16(22)19-13-8-11(3-5-14(13)25-9)27(23,24)21-17-20-12-4-2-10(18)7-15(12)26-17/h2-5,7-9H,6H2,1H3,(H,19,22)(H,20,21)