3-[[3-oxidanyl-3-oxidanylidene-2-(quinoxalin-2-ylcarbonylamino)propyl]disulfanyl]-2-(quinoxalin-2-ylcarbonylamino)propanoic acid

Systemtic Name: 3-[[3-oxidanyl-3-oxidanylidene-2-(quinoxalin-2-ylcarbonylamino)propyl]disulfanyl]-2-(quinoxalin-2-ylcarbonylamino)propanoic acid Openeye Name: 3-[[3-hydroxy-3-oxo-2-(quinoxaline-2-carbonylamino)propyl]disulfanyl]-2-(quinoxaline-2-carbonylamino)propanoic acid CAS Name: 3-[[3-hydroxy-3-oxo-2-[[oxo(2-quinoxalinyl)methyl]amino]propyl]disulfanyl]-2-[[oxo(2-quinoxalinyl)methyl]amino]propanoic acid IUPAC Name: 3-[[3-hydroxy-3-oxo-2-(quinoxaline-2-carbonylamino)propyl]disulfanyl]-2-(quinoxaline-2-carbonylamino)propanoic acid Traditional Name: 3-[[3-hydroxy-3-keto-2-(quinoxaline-2-carbonylamino)propyl]disulfanyl]-2-(quinoxaline-2-carbonylamino)propionic acid Formula: C24H20N6O6S2 MolecularWeight: 552.5822

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CC(=N2)C(=O)NC(CSSCC(C(=O)O)NC(=O)C3=NC4=CC=CC=C4N=C3)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=CC(=N2)C(=O)NC(CSSCC(C(=O)O)NC(=O)C3=NC4=CC=CC=C4N=C3)C(=O)O

InChI

InChI=1S/C24H20N6O6S2/c31-21(17-9-25-13-5-1-3-7-15(13)27-17)29-19(23(33)34)11-37-38-12-20(24(35)36)30-22(32)18-10-26-14-6-2-4-8-16(14)28-18/h1-10,19-20H,11-12H2,(H,29,31)(H,30,32)(H,33,34)(H,35,36)