S-[(4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)] N-(2-chloranylpyridin-3-yl)carbamothioate

Systemtic Name: S-[(4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)] N-(2-chloranylpyridin-3-yl)carbamothioate Openeye Name: S-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)] N-(2-chloro-3-pyridyl)carbamothioate CAS Name: N-(2-chloro-3-pyridinyl)carbamothioic acid S-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)] ester IUPAC Name: S-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)] N-(2-chloropyridin-3-yl)carbamothioate Traditional Name: N-(2-chloro-3-pyridyl)thiocarbamic acid S-[(4-hydroxy-6-keto-1H-pyrimidin-2-yl)] ester Formula: C10H7ClN4O3S MolecularWeight: 298.70558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)Cl)NC(=O)SC2=NC(=CC(=O)N2)O

Isomeric SMILES

C1=CC(=C(N=C1)Cl)NC(=O)SC2=NC(=CC(=O)N2)O

InChI

InChI=1S/C10H7ClN4O3S/c11-8-5(2-1-3-12-8)13-10(18)19-9-14-6(16)4-7(17)15-9/h1-4H,(H,13,18)(H2,14,15,16,17)