(E)-4-[[2-(5,6-dimethyl-4-oxidanylidene-1H-pyrimidin-2-yl)-5-methyl-pyrazol-3-yl]amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[[2-(5,6-dimethyl-4-oxidanylidene-1H-pyrimidin-2-yl)-5-methyl-pyrazol-3-yl]amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[[2-(5,6-dimethyl-4-oxo-1H-pyrimidin-2-yl)-5-methyl-pyrazol-3-yl]amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[2-(5,6-dimethyl-4-oxo-1H-pyrimidin-2-yl)-5-methyl-3-pyrazolyl]amino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[[2-(5,6-dimethyl-4-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]amino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-keto-4-[[2-(4-keto-5,6-dimethyl-1H-pyrimidin-2-yl)-5-methyl-pyrazol-3-yl]amino]but-2-enoic acid Formula: C14H15N5O4 MolecularWeight: 317.3

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C=CC(=O)O)C2=NC(=O)C(=C(N2)C)C

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)/C=C/C(=O)O)C2=NC(=O)C(=C(N2)C)C

InChI

InChI=1S/C14H15N5O4/c1-7-6-10(16-11(20)4-5-12(21)22)19(18-7)14-15-9(3)8(2)13(23)17-14/h4-6H,1-3H3,(H,16,20)(H,21,22)(H,15,17,23)/b5-4+