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

Systemtic Name: N-methyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-methyl-N-[[1-(phenylmethyl)-4-pyrazolyl]methyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-piazthiole-4-sulfonamide Formula: C18H17N5O2S2 MolecularWeight: 399.48988

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

CN(CC1=CN(N=C1)CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C18H17N5O2S2/c1-22(27(24,25)17-9-5-8-16-18(17)21-26-20-16)11-15-10-19-23(13-15)12-14-6-3-2-4-7-14/h2-10,13H,11-12H2,1H3