methyl 3-[[4-(pyrazol-1-ylmethyl)phenyl]methylsulfamoyl]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[4-(pyrazol-1-ylmethyl)phenyl]methylsulfamoyl]thiophene-2-carboxylate Openeye Name: methyl 3-[[4-(pyrazol-1-ylmethyl)phenyl]methylsulfamoyl]thiophene-2-carboxylate CAS Name: 3-[[4-(1-pyrazolylmethyl)phenyl]methylsulfamoyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[4-(pyrazol-1-ylmethyl)phenyl]methylsulfamoyl]thiophene-2-carboxylate Traditional Name: 3-[[4-(pyrazol-1-ylmethyl)benzyl]sulfamoyl]thiophene-2-carboxylic acid methyl ester Formula: C17H17N3O4S2 MolecularWeight: 391.46458

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)S(=O)(=O)NCC2=CC=C(C=C2)CN3C=CC=N3

Isomeric SMILES

COC(=O)C1=C(C=CS1)S(=O)(=O)NCC2=CC=C(C=C2)CN3C=CC=N3

InChI

InChI=1S/C17H17N3O4S2/c1-24-17(21)16-15(7-10-25-16)26(22,23)19-11-13-3-5-14(6-4-13)12-20-9-2-8-18-20/h2-10,19H,11-12H2,1H3