5-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]azanidylsulfonyl]-6-oxidanylidene-1H-pyrimidin-2-olate

Systemtic Name: 5-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]azanidylsulfonyl]-6-oxidanylidene-1H-pyrimidin-2-olate Openeye Name: 5-[3-(4-methoxyphenyl)isoxazol-5-yl]azanidylsulfonyl-6-oxo-1H-pyrimidin-2-olate CAS Name: 5-[[3-(4-methoxyphenyl)-5-isoxazolyl]azanidylsulfonyl]-6-oxo-1H-pyrimidin-2-olate IUPAC Name: 5-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]azanidylsulfonyl]-6-oxo-1H-pyrimidin-2-olate Traditional Name: 6-keto-5-[3-(4-methoxyphenyl)isoxazol-5-yl]azanidylsulfonyl-1H-pyrimidin-2-olate Formula: C14H10N4O6S-2 MolecularWeight: 362.3174

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NOC(=C2)[N-]S(=O)(=O)C3=CN=C(NC3=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NOC(=C2)[N-]S(=O)(=O)C3=CN=C(NC3=O)[O-]

InChI

InChI=1S/C14H12N4O6S/c1-23-9-4-2-8(3-5-9)10-6-12(24-17-10)18-25(21,22)11-7-15-14(20)16-13(11)19/h2-7H,1H3,(H3,15,16,17,18,19,20)/p-2