5-ethyl-6-methyl-2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-pyrimidin-4-olate

Systemtic Name: 5-ethyl-6-methyl-2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-pyrimidin-4-olate Openeye Name: 5-ethyl-6-methyl-2-[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]sulfanyl-pyrimidin-4-olate CAS Name: 5-ethyl-6-methyl-2-[[2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl]thio]-4-pyrimidinolate IUPAC Name: 5-ethyl-6-methyl-2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]sulfanylpyrimidin-4-olate Traditional Name: 5-ethyl-2-[[2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl]thio]-6-methyl-pyrimidin-4-olate Formula: C13H15N4O3S- MolecularWeight: 307.3482

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(N=C1[O-])SCC(=O)NC2=NOC(=C2)C)C

Isomeric SMILES

CCC1=C(N=C(N=C1[O-])SCC(=O)NC2=NOC(=C2)C)C

InChI

InChI=1S/C13H16N4O3S/c1-4-9-8(3)14-13(16-12(9)19)21-6-11(18)15-10-5-7(2)20-17-10/h5H,4,6H2,1-3H3,(H,14,16,19)(H,15,17,18)/p-1