4-[(1,3-benzothiazol-6-ylcarbonylamino)carbamoyl]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 4-[(1,3-benzothiazol-6-ylcarbonylamino)carbamoyl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 4-[(1,3-benzothiazole-6-carbonylamino)carbamoyl]-N,N-dimethyl-benzenesulfonamide CAS Name: 4-[[[1,3-benzothiazol-6-yl(oxo)methyl]hydrazo]-oxomethyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 4-[(1,3-benzothiazole-6-carbonylamino)carbamoyl]-N,N-dimethylbenzenesulfonamide Traditional Name: 4-[(1,3-benzothiazole-6-carbonylamino)carbamoyl]-N,N-dimethyl-benzenesulfonamide Formula: C17H16N4O4S2 MolecularWeight: 404.46334

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NNC(=O)C2=CC3=C(C=C2)N=CS3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NNC(=O)C2=CC3=C(C=C2)N=CS3

InChI

InChI=1S/C17H16N4O4S2/c1-21(2)27(24,25)13-6-3-11(4-7-13)16(22)19-20-17(23)12-5-8-14-15(9-12)26-10-18-14/h3-10H,1-2H3,(H,19,22)(H,20,23)