2-[[4-[[2-azanyl-4-(dimethylamino)pteridin-6-yl]methyl-methyl-amino]phenyl]carbonylamino]pentanedioic acid

Systemtic Name: 2-[[4-[[2-azanyl-4-(dimethylamino)pteridin-6-yl]methyl-methyl-amino]phenyl]carbonylamino]pentanedioic acid Openeye Name: 2-[[4-[[2-amino-4-(dimethylamino)pteridin-6-yl]methyl-methyl-amino]benzoyl]amino]pentanedioic acid CAS Name: 2-[[[4-[[2-amino-4-(dimethylamino)-6-pteridinyl]methyl-methylamino]phenyl]-oxomethyl]amino]pentanedioic acid IUPAC Name: 2-[[4-[[2-amino-4-(dimethylamino)pteridin-6-yl]methyl-methylamino]benzoyl]amino]pentanedioic acid Traditional Name: 2-[[4-[[2-amino-4-(dimethylamino)pteridin-6-yl]methyl-methyl-amino]benzoyl]amino]glutaric acid Formula: C22H26N8O5 MolecularWeight: 482.49244

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC2=NC=C(N=C21)CN(C)C3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O)N

Isomeric SMILES

CN(C)C1=NC(=NC2=NC=C(N=C21)CN(C)C3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O)N

InChI

InChI=1S/C22H26N8O5/c1-29(2)19-17-18(27-22(23)28-19)24-10-13(25-17)11-30(3)14-6-4-12(5-7-14)20(33)26-15(21(34)35)8-9-16(31)32/h4-7,10,15H,8-9,11H2,1-3H3,(H,26,33)(H,31,32)(H,34,35)(H2,23,24,27,28)