azanium 5-[(2-chlorophenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-olate

Systemtic Name: azanium 5-[(2-chlorophenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-olate Openeye Name: ammonium 5-[(2-chlorophenyl)methyl]-4-oxo-2-thioxo-1H-pyrimidin-6-olate CAS Name: ammonium 5-[(2-chlorophenyl)methyl]-4-oxo-2-sulfanylidene-1H-pyrimidin-6-olate IUPAC Name: azanium 5-[(2-chlorophenyl)methyl]-4-oxo-2-sulfanylidene-1H-pyrimidin-6-olate Traditional Name: ammonium 5-(2-chlorobenzyl)-4-keto-2-thioxo-1H-pyrimidin-6-olate Formula: C11H12ClN3O2S MolecularWeight: 285.74988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC2=C(NC(=S)NC2=O)[O-])Cl.[NH4+]

Isomeric SMILES

C1=CC=C(C(=C1)CC2=C(NC(=S)NC2=O)[O-])Cl.[NH4+]

InChI

InChI=1S/C11H9ClN2O2S.H3N/c12-8-4-2-1-3-6(8)5-7-9(15)13-11(17)14-10(7)16;/h1-4H,5H2,(H3,13,14,15,16,17);1H3