4-[[5-methyl-2-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)pyrazol-3-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[5-methyl-2-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)pyrazol-3-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[5-methyl-2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]amino]-4-oxo-butanoic acid CAS Name: 4-[[5-methyl-2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)-3-pyrazolyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[5-methyl-2-(6-methyl-4-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]amino]-4-oxobutanoic acid Traditional Name: 4-keto-4-[[2-(4-keto-6-methyl-1H-pyrimidin-2-yl)-5-methyl-pyrazol-3-yl]amino]butyric acid Formula: C13H15N5O4 MolecularWeight: 305.2893

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)N2C(=CC(=N2)C)NC(=O)CCC(=O)O

Isomeric SMILES

CC1=CC(=O)N=C(N1)N2C(=CC(=N2)C)NC(=O)CCC(=O)O

InChI

InChI=1S/C13H15N5O4/c1-7-6-11(20)16-13(14-7)18-9(5-8(2)17-18)15-10(19)3-4-12(21)22/h5-6H,3-4H2,1-2H3,(H,15,19)(H,21,22)(H,14,16,20)