5-methyl-1-phenyl-2-sulfanylidene-pyrimidine-4,6-diolate

Systemtic Name: 5-methyl-1-phenyl-2-sulfanylidene-pyrimidine-4,6-diolate Openeye Name: 5-methyl-1-phenyl-2-thioxo-pyrimidine-4,6-diolate CAS Name: 5-methyl-1-phenyl-2-sulfanylidenepyrimidine-4,6-diolate IUPAC Name: 5-methyl-1-phenyl-2-sulfanylidenepyrimidine-4,6-diolate Traditional Name: 5-methyl-1-phenyl-2-thioxo-pyrimidine-4,6-diolate Formula: C11H8N2O2S-2 MolecularWeight: 232.25842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=S)N=C1[O-])C2=CC=CC=C2)[O-]

Isomeric SMILES

CC1=C(N(C(=S)N=C1[O-])C2=CC=CC=C2)[O-]

InChI

InChI=1S/C11H10N2O2S/c1-7-9(14)12-11(16)13(10(7)15)8-5-3-2-4-6-8/h2-6,15H,1H3,(H,12,14,16)/p-2