[4-(2,1,3-benzothiadiazol-4-ylsulfonylamino)pyrazol-1-yl]methyl 2,2-dimethylpropanoate

Systemtic Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonylamino)pyrazol-1-yl]methyl 2,2-dimethylpropanoate Openeye Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonylamino)pyrazol-1-yl]methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [4-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-1-pyrazolyl]methyl ester IUPAC Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonylamino)pyrazol-1-yl]methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [4-(piazthiol-4-ylsulfonylamino)pyrazol-1-yl]methyl ester Formula: C15H17N5O4S2 MolecularWeight: 395.45658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCN1C=C(C=N1)NS(=O)(=O)C2=CC=CC3=NSN=C32

Isomeric SMILES

CC(C)(C)C(=O)OCN1C=C(C=N1)NS(=O)(=O)C2=CC=CC3=NSN=C32

InChI

InChI=1S/C15H17N5O4S2/c1-15(2,3)14(21)24-9-20-8-10(7-16-20)19-26(22,23)12-6-4-5-11-13(12)18-25-17-11/h4-8,19H,9H2,1-3H3