4-methoxy-N-(6-thiomorpholin-4-ylcarbonyl-1,3-benzothiazol-2-yl)benzenesulfonamide

Systemtic Name: 4-methoxy-N-(6-thiomorpholin-4-ylcarbonyl-1,3-benzothiazol-2-yl)benzenesulfonamide Openeye Name: 4-methoxy-N-[6-(thiomorpholine-4-carbonyl)-1,3-benzothiazol-2-yl]benzenesulfonamide CAS Name: 4-methoxy-N-[6-[oxo(thiomorpholin-4-yl)methyl]-1,3-benzothiazol-2-yl]benzenesulfonamide IUPAC Name: 4-methoxy-N-[6-(thiomorpholine-4-carbonyl)-1,3-benzothiazol-2-yl]benzenesulfonamide Traditional Name: 4-methoxy-N-[6-(thiomorpholine-4-carbonyl)-1,3-benzothiazol-2-yl]benzenesulfonamide Formula: C19H19N3O4S3 MolecularWeight: 449.56686

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)N4CCSCC4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)N4CCSCC4

InChI

InChI=1S/C19H19N3O4S3/c1-26-14-3-5-15(6-4-14)29(24,25)21-19-20-16-7-2-13(12-17(16)28-19)18(23)22-8-10-27-11-9-22/h2-7,12H,8-11H2,1H3,(H,20,21)