2-[[4-[(3-thiophen-2-ylquinoxalin-2-yl)amino]phenyl]carbonylamino]pentanedioic acid

Systemtic Name: 2-[[4-[(3-thiophen-2-ylquinoxalin-2-yl)amino]phenyl]carbonylamino]pentanedioic acid Openeye Name: 2-[[4-[[3-(2-thienyl)quinoxalin-2-yl]amino]benzoyl]amino]pentanedioic acid CAS Name: 2-[[oxo-[4-[(3-thiophen-2-yl-2-quinoxalinyl)amino]phenyl]methyl]amino]pentanedioic acid IUPAC Name: 2-[[4-[(3-thiophen-2-ylquinoxalin-2-yl)amino]benzoyl]amino]pentanedioic acid Traditional Name: 2-[[4-[[3-(2-thienyl)quinoxalin-2-yl]amino]benzoyl]amino]glutaric acid Formula: C24H20N4O5S MolecularWeight: 476.5044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(C(=N2)NC3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(C(=N2)NC3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O)C4=CC=CS4

InChI

InChI=1S/C24H20N4O5S/c29-20(30)12-11-18(24(32)33)28-23(31)14-7-9-15(10-8-14)25-22-21(19-6-3-13-34-19)26-16-4-1-2-5-17(16)27-22/h1-10,13,18H,11-12H2,(H,25,27)(H,28,31)(H,29,30)(H,32,33)