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

Systemtic Name: methyl 3-[[1-(phenylsulfanylmethyl)pyrazol-4-yl]sulfamoyl]thiophene-2-carboxylate Openeye Name: methyl 3-[[1-(phenylsulfanylmethyl)pyrazol-4-yl]sulfamoyl]thiophene-2-carboxylate CAS Name: 3-[[1-[(phenylthio)methyl]-4-pyrazolyl]sulfamoyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[1-(phenylsulfanylmethyl)pyrazol-4-yl]sulfamoyl]thiophene-2-carboxylate Traditional Name: 3-[[1-[(phenylthio)methyl]pyrazol-4-yl]sulfamoyl]thiophene-2-carboxylic acid methyl ester Formula: C16H15N3O4S3 MolecularWeight: 409.503

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)S(=O)(=O)NC2=CN(N=C2)CSC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(C=CS1)S(=O)(=O)NC2=CN(N=C2)CSC3=CC=CC=C3

InChI

InChI=1S/C16H15N3O4S3/c1-23-16(20)15-14(7-8-24-15)26(21,22)18-12-9-17-19(10-12)11-25-13-5-3-2-4-6-13/h2-10,18H,11H2,1H3