N-[2-(1,3-benzothiazol-2-yl)phenyl]-2-methylsulfonyl-benzenesulfonamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-2-methylsulfonyl-benzenesulfonamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-2-methylsulfonyl-benzenesulfonamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-2-methylsulfonylbenzenesulfonamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-2-methylsulfonylbenzenesulfonamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-2-mesyl-benzenesulfonamide Formula: C20H16N2O4S3 MolecularWeight: 444.54704

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1S(=O)(=O)NC2=CC=CC=C2C3=NC4=CC=CC=C4S3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1S(=O)(=O)NC2=CC=CC=C2C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H16N2O4S3/c1-28(23,24)18-12-6-7-13-19(18)29(25,26)22-15-9-3-2-8-14(15)20-21-16-10-4-5-11-17(16)27-20/h2-13,22H,1H3