S-phenyl 5-chloranyl-2-methylsulfanyl-pyrimidine-4-carbothioate

Systemtic Name: S-phenyl 5-chloranyl-2-methylsulfanyl-pyrimidine-4-carbothioate Openeye Name: S-phenyl 5-chloro-2-methylsulfanyl-pyrimidine-4-carbothioate CAS Name: 5-chloro-2-(methylthio)-4-pyrimidinecarbothioic acid S-phenyl ester IUPAC Name: S-phenyl 5-chloro-2-methylsulfanylpyrimidine-4-carbothioate Traditional Name: 5-chloro-2-(methylthio)pyrimidine-4-carbothioic acid S-phenyl ester Formula: C12H9ClN2OS2 MolecularWeight: 296.79566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)SC2=CC=CC=C2)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)SC2=CC=CC=C2)Cl

InChI

InChI=1S/C12H9ClN2OS2/c1-17-12-14-7-9(13)10(15-12)11(16)18-8-5-3-2-4-6-8/h2-7H,1H3