methyl 4-(4-methylphenyl)-3-[(3-methylsulfanylphenyl)sulfamoyl]thiophene-2-carboxylate

Systemtic Name: methyl 4-(4-methylphenyl)-3-[(3-methylsulfanylphenyl)sulfamoyl]thiophene-2-carboxylate Openeye Name: methyl 3-[(3-methylsulfanylphenyl)sulfamoyl]-4-(p-tolyl)thiophene-2-carboxylate CAS Name: 4-(4-methylphenyl)-3-[[3-(methylthio)phenyl]sulfamoyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-methylphenyl)-3-[(3-methylsulfanylphenyl)sulfamoyl]thiophene-2-carboxylate Traditional Name: 3-[[3-(methylthio)phenyl]sulfamoyl]-4-(p-tolyl)thiophene-2-carboxylic acid methyl ester Formula: C20H19NO4S3 MolecularWeight: 433.56416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=C2S(=O)(=O)NC3=CC(=CC=C3)SC)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=C2S(=O)(=O)NC3=CC(=CC=C3)SC)C(=O)OC

InChI

InChI=1S/C20H19NO4S3/c1-13-7-9-14(10-8-13)17-12-27-18(20(22)25-2)19(17)28(23,24)21-15-5-4-6-16(11-15)26-3/h4-12,21H,1-3H3