2-[[4-[(6-aminocarbonyl-5-azanyl-pyrazin-2-yl)methyl-methanoyl-amino]phenyl]carbonylamino]pentanedioic acid

Systemtic Name: 2-[[4-[(6-aminocarbonyl-5-azanyl-pyrazin-2-yl)methyl-methanoyl-amino]phenyl]carbonylamino]pentanedioic acid Openeye Name: 2-[[4-[(5-amino-6-carbamoyl-pyrazin-2-yl)methyl-formyl-amino]benzoyl]amino]pentanedioic acid CAS Name: 2-[[[4-[(5-amino-6-carbamoyl-2-pyrazinyl)methyl-formylamino]phenyl]-oxomethyl]amino]pentanedioic acid IUPAC Name: 2-[[4-[(5-amino-6-carbamoylpyrazin-2-yl)methyl-formylamino]benzoyl]amino]pentanedioic acid Traditional Name: 2-[[4-[(5-amino-6-carbamoyl-pyrazin-2-yl)methyl-formyl-amino]benzoyl]amino]glutaric acid Formula: C19H20N6O7 MolecularWeight: 444.3981

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC(CCC(=O)O)C(=O)O)N(CC2=CN=C(C(=N2)C(=O)N)N)C=O

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC(CCC(=O)O)C(=O)O)N(CC2=CN=C(C(=N2)C(=O)N)N)C=O

InChI

InChI=1S/C19H20N6O7/c20-16-15(17(21)29)23-11(7-22-16)8-25(9-26)12-3-1-10(2-4-12)18(30)24-13(19(31)32)5-6-14(27)28/h1-4,7,9,13H,5-6,8H2,(H2,20,22)(H2,21,29)(H,24,30)(H,27,28)(H,31,32)