3-[(2H-benzotriazol-5-ylcarbonylamino)carbamoyl]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 3-[(2H-benzotriazol-5-ylcarbonylamino)carbamoyl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 3-[(2H-benzotriazole-5-carbonylamino)carbamoyl]-N,N-dimethyl-benzenesulfonamide CAS Name: 3-[[[2H-benzotriazol-5-yl(oxo)methyl]hydrazo]-oxomethyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 3-[(2H-benzotriazole-5-carbonylamino)carbamoyl]-N,N-dimethylbenzenesulfonamide Traditional Name: 3-[(2H-benzotriazole-5-carbonylamino)carbamoyl]-N,N-dimethyl-benzenesulfonamide Formula: C16H16N6O4S MolecularWeight: 388.40104

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)C2=CC3=NNN=C3C=C2

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)C2=CC3=NNN=C3C=C2

InChI

InChI=1S/C16H16N6O4S/c1-22(2)27(25,26)12-5-3-4-10(8-12)15(23)19-20-16(24)11-6-7-13-14(9-11)18-21-17-13/h3-9H,1-2H3,(H,19,23)(H,20,24)(H,17,18,21)