[2-oxidanylidene-2-[(2-prop-2-enylsulfanylphenyl)amino]ethyl] 5-sulfamoylthiophene-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(2-prop-2-enylsulfanylphenyl)amino]ethyl] 5-sulfamoylthiophene-3-carboxylate Openeye Name: [2-(2-allylsulfanylanilino)-2-oxo-ethyl] 5-sulfamoylthiophene-3-carboxylate CAS Name: 5-sulfamoyl-3-thiophenecarboxylic acid [2-oxo-2-[2-(prop-2-enylthio)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(2-prop-2-enylsulfanylanilino)ethyl] 5-sulfamoylthiophene-3-carboxylate Traditional Name: 5-sulfamoylthiophene-3-carboxylic acid [2-[2-(allylthio)anilino]-2-keto-ethyl] ester Formula: C16H16N2O5S3 MolecularWeight: 412.50364

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=CC=CC=C1NC(=O)COC(=O)C2=CSC(=C2)S(=O)(=O)N

Isomeric SMILES

C=CCSC1=CC=CC=C1NC(=O)COC(=O)C2=CSC(=C2)S(=O)(=O)N

InChI

InChI=1S/C16H16N2O5S3/c1-2-7-24-13-6-4-3-5-12(13)18-14(19)9-23-16(20)11-8-15(25-10-11)26(17,21)22/h2-6,8,10H,1,7,9H2,(H,18,19)(H2,17,21,22)