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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NOC(=C1)C)SC2=NC(=CC(=N2)[O-])C

Isomeric SMILES

CC[C@@H](C(=O)NC1=NOC(=C1)C)SC2=NC(=CC(=N2)[O-])C

InChI

InChI=1S/C13H16N4O3S/c1-4-9(12(19)15-10-6-8(3)20-17-10)21-13-14-7(2)5-11(18)16-13/h5-6,9H,4H2,1-3H3,(H,14,16,18)(H,15,17,19)/p-1/t9-/m0/s1