methyl 2-[[2-[(4-sulfamoylphenyl)carbamoyl]phenyl]disulfanyl]benzoate

Systemtic Name: methyl 2-[[2-[(4-sulfamoylphenyl)carbamoyl]phenyl]disulfanyl]benzoate Openeye Name: methyl 2-[[2-[(4-sulfamoylphenyl)carbamoyl]phenyl]disulfanyl]benzoate CAS Name: 2-[[2-[oxo-(4-sulfamoylanilino)methyl]phenyl]disulfanyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[(4-sulfamoylphenyl)carbamoyl]phenyl]disulfanyl]benzoate Traditional Name: 2-[[2-[(4-sulfamoylphenyl)carbamoyl]phenyl]disulfanyl]benzoic acid methyl ester Formula: C21H18N2O5S3 MolecularWeight: 474.57302

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1SSC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

COC(=O)C1=CC=CC=C1SSC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C21H18N2O5S3/c1-28-21(25)17-7-3-5-9-19(17)30-29-18-8-4-2-6-16(18)20(24)23-14-10-12-15(13-11-14)31(22,26)27/h2-13H,1H3,(H,23,24)(H2,22,26,27)