3,4-dimethoxy-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)benzenesulfonamide

Systemtic Name: 3,4-dimethoxy-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)benzenesulfonamide Openeye Name: 3,4-dimethoxy-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)benzenesulfonamide CAS Name: 3,4-dimethoxy-N-[2-(methylthio)-1,3-benzothiazol-6-yl]benzenesulfonamide IUPAC Name: 3,4-dimethoxy-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)benzenesulfonamide Traditional Name: 3,4-dimethoxy-N-[2-(methylthio)-1,3-benzothiazol-6-yl]benzenesulfonamide Formula: C16H16N2O4S3 MolecularWeight: 396.50424

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)N=C(S3)SC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)N=C(S3)SC)OC

InChI

InChI=1S/C16H16N2O4S3/c1-21-13-7-5-11(9-14(13)22-2)25(19,20)18-10-4-6-12-15(8-10)24-16(17-12)23-3/h4-9,18H,1-3H3