2-[[4-[4-(2-azanyl-4-methyl-pyrimidin-5-yl)butyl]phenyl]carbonylamino]pentanedioic acid

Systemtic Name: 2-[[4-[4-(2-azanyl-4-methyl-pyrimidin-5-yl)butyl]phenyl]carbonylamino]pentanedioic acid Openeye Name: 2-[[4-[4-(2-amino-4-methyl-pyrimidin-5-yl)butyl]benzoyl]amino]pentanedioic acid CAS Name: 2-[[[4-[4-(2-amino-4-methyl-5-pyrimidinyl)butyl]phenyl]-oxomethyl]amino]pentanedioic acid IUPAC Name: 2-[[4-[4-(2-amino-4-methylpyrimidin-5-yl)butyl]benzoyl]amino]pentanedioic acid Traditional Name: 2-[[4-[4-(2-amino-4-methyl-pyrimidin-5-yl)butyl]benzoyl]amino]glutaric acid Formula: C21H26N4O5 MolecularWeight: 414.45494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1CCCCC2=CC=C(C=C2)C(=O)NC(CCC(=O)O)C(=O)O)N

Isomeric SMILES

CC1=NC(=NC=C1CCCCC2=CC=C(C=C2)C(=O)NC(CCC(=O)O)C(=O)O)N

InChI

InChI=1S/C21H26N4O5/c1-13-16(12-23-21(22)24-13)5-3-2-4-14-6-8-15(9-7-14)19(28)25-17(20(29)30)10-11-18(26)27/h6-9,12,17H,2-5,10-11H2,1H3,(H,25,28)(H,26,27)(H,29,30)(H2,22,23,24)