methyl (2R)-2-acetamido-3-[[2-[(4-sulfamoylphenyl)carbamoyl]phenyl]disulfanyl]propanoate

Systemtic Name: methyl (2R)-2-acetamido-3-[[2-[(4-sulfamoylphenyl)carbamoyl]phenyl]disulfanyl]propanoate Openeye Name: methyl (2R)-2-acetamido-3-[[2-[(4-sulfamoylphenyl)carbamoyl]phenyl]disulfanyl]propanoate CAS Name: (2R)-2-acetamido-3-[[2-[oxo-(4-sulfamoylanilino)methyl]phenyl]disulfanyl]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-acetamido-3-[[2-[(4-sulfamoylphenyl)carbamoyl]phenyl]disulfanyl]propanoate Traditional Name: (2R)-2-acetamido-3-[[2-[(4-sulfamoylphenyl)carbamoyl]phenyl]disulfanyl]propionic acid methyl ester Formula: C19H21N3O6S3 MolecularWeight: 483.58154

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSSC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)S(=O)(=O)N)C(=O)OC

Isomeric SMILES

CC(=O)N[C@@H](CSSC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)S(=O)(=O)N)C(=O)OC

InChI

InChI=1S/C19H21N3O6S3/c1-12(23)21-16(19(25)28-2)11-29-30-17-6-4-3-5-15(17)18(24)22-13-7-9-14(10-8-13)31(20,26)27/h3-10,16H,11H2,1-2H3,(H,21,23)(H,22,24)(H2,20,26,27)/t16-/m0/s1