(4-methylsulfanylphenyl)methyl 4-[(2-azanyl-2-oxidanylidene-ethyl)sulfamoyl]benzoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 4-[(2-azanyl-2-oxidanylidene-ethyl)sulfamoyl]benzoate Openeye Name: (4-methylsulfanylphenyl)methyl 4-[(2-amino-2-oxo-ethyl)sulfamoyl]benzoate CAS Name: 4-[(2-amino-2-oxoethyl)sulfamoyl]benzoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 4-[(2-amino-2-oxoethyl)sulfamoyl]benzoate Traditional Name: 4-[(2-amino-2-keto-ethyl)sulfamoyl]benzoic acid [4-(methylthio)benzyl] ester Formula: C17H18N2O5S2 MolecularWeight: 394.46522

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)S(=O)(=O)NCC(=O)N

Isomeric SMILES

CSC1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)S(=O)(=O)NCC(=O)N

InChI

InChI=1S/C17H18N2O5S2/c1-25-14-6-2-12(3-7-14)11-24-17(21)13-4-8-15(9-5-13)26(22,23)19-10-16(18)20/h2-9,19H,10-11H2,1H3,(H2,18,20)