5-azanyl-2-[2-[methyl(pyrimidin-2-yl)amino]ethanoylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[2-[methyl(pyrimidin-2-yl)amino]ethanoylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[[2-[methyl(pyrimidin-2-yl)amino]acetyl]amino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[[2-[methyl(2-pyrimidinyl)amino]-1-oxoethyl]amino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[[2-[methyl(pyrimidin-2-yl)amino]acetyl]amino]-5-oxopentanoic acid Traditional Name: 5-amino-5-keto-2-[[2-[methyl(2-pyrimidyl)amino]acetyl]amino]valeric acid Formula: C12H17N5O4 MolecularWeight: 295.29448

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC(CCC(=O)N)C(=O)O)C1=NC=CC=N1

Isomeric SMILES

CN(CC(=O)NC(CCC(=O)N)C(=O)O)C1=NC=CC=N1

InChI

InChI=1S/C12H17N5O4/c1-17(12-14-5-2-6-15-12)7-10(19)16-8(11(20)21)3-4-9(13)18/h2,5-6,8H,3-4,7H2,1H3,(H2,13,18)(H,16,19)(H,20,21)