methyl 3-[methyl-[(1-phenylpyrazol-4-yl)methyl]sulfamoyl]thiophene-2-carboxylate

Systemtic Name: methyl 3-[methyl-[(1-phenylpyrazol-4-yl)methyl]sulfamoyl]thiophene-2-carboxylate Openeye Name: methyl 3-[methyl-[(1-phenylpyrazol-4-yl)methyl]sulfamoyl]thiophene-2-carboxylate CAS Name: 3-[methyl-[(1-phenyl-4-pyrazolyl)methyl]sulfamoyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[methyl-[(1-phenylpyrazol-4-yl)methyl]sulfamoyl]thiophene-2-carboxylate Traditional Name: 3-[methyl-[(1-phenylpyrazol-4-yl)methyl]sulfamoyl]thiophene-2-carboxylic acid methyl ester Formula: C17H17N3O4S2 MolecularWeight: 391.46458

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)C2=CC=CC=C2)S(=O)(=O)C3=C(SC=C3)C(=O)OC

Isomeric SMILES

CN(CC1=CN(N=C1)C2=CC=CC=C2)S(=O)(=O)C3=C(SC=C3)C(=O)OC

InChI

InChI=1S/C17H17N3O4S2/c1-19(26(22,23)15-8-9-25-16(15)17(21)24-2)11-13-10-18-20(12-13)14-6-4-3-5-7-14/h3-10,12H,11H2,1-2H3