N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-2-oxidanylidene-3H-1,3-benzothiazole-6-sulfonamide

Systemtic Name: N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-2-oxidanylidene-3H-1,3-benzothiazole-6-sulfonamide Openeye Name: 2-oxo-N-[4-(p-tolylsulfonylamino)phenyl]-3H-1,3-benzothiazole-6-sulfonamide CAS Name: N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-2-oxo-3H-1,3-benzothiazole-6-sulfonamide IUPAC Name: N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-2-oxo-3H-1,3-benzothiazole-6-sulfonamide Traditional Name: 2-keto-N-[4-(tosylamino)phenyl]-3H-1,3-benzothiazole-6-sulfonamide Formula: C20H17N3O5S3 MolecularWeight: 475.56108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)NC(=O)S4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)NC(=O)S4

InChI

InChI=1S/C20H17N3O5S3/c1-13-2-8-16(9-3-13)30(25,26)22-14-4-6-15(7-5-14)23-31(27,28)17-10-11-18-19(12-17)29-20(24)21-18/h2-12,22-23H,1H3,(H,21,24)