N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-methyl-N-[(1-methyl-4-pyrazolyl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-methyl-N-[(1-methylpyrazol-4-yl)methyl]piazthiole-4-sulfonamide Formula: C12H13N5O2S2 MolecularWeight: 323.39392

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CN(C)S(=O)(=O)C2=CC=CC3=NSN=C32

Isomeric SMILES

CN1C=C(C=N1)CN(C)S(=O)(=O)C2=CC=CC3=NSN=C32

InChI

InChI=1S/C12H13N5O2S2/c1-16-7-9(6-13-16)8-17(2)21(18,19)11-5-3-4-10-12(11)15-20-14-10/h3-7H,8H2,1-2H3