N-[3-(1,3-benzothiazol-2-ylamino)phenyl]-4-methylsulfonyl-benzenesulfonamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-ylamino)phenyl]-4-methylsulfonyl-benzenesulfonamide Openeye Name: N-[3-(1,3-benzothiazol-2-ylamino)phenyl]-4-methylsulfonyl-benzenesulfonamide CAS Name: N-[3-(1,3-benzothiazol-2-ylamino)phenyl]-4-methylsulfonylbenzenesulfonamide IUPAC Name: N-[3-(1,3-benzothiazol-2-ylamino)phenyl]-4-methylsulfonylbenzenesulfonamide Traditional Name: N-[3-(1,3-benzothiazol-2-ylamino)phenyl]-4-mesyl-benzenesulfonamide Formula: C20H17N3O4S3 MolecularWeight: 459.56168

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H17N3O4S3/c1-29(24,25)16-9-11-17(12-10-16)30(26,27)23-15-6-4-5-14(13-15)21-20-22-18-7-2-3-8-19(18)28-20/h2-13,23H,1H3,(H,21,22)