4-chloranyl-6-methylsulfanyl-2-phenyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-chloranyl-6-methylsulfanyl-2-phenyl-pyrimidine-5-carbonitrile Openeye Name: 4-chloro-6-methylsulfanyl-2-phenyl-pyrimidine-5-carbonitrile CAS Name: 4-chloro-6-(methylthio)-2-phenyl-5-pyrimidinecarbonitrile IUPAC Name: 4-chloro-6-methylsulfanyl-2-phenylpyrimidine-5-carbonitrile Traditional Name: 4-chloro-6-(methylthio)-2-phenyl-pyrimidine-5-carbonitrile Formula: C12H8ClN3S MolecularWeight: 261.73002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=NC(=N1)C2=CC=CC=C2)Cl)C#N

Isomeric SMILES

CSC1=C(C(=NC(=N1)C2=CC=CC=C2)Cl)C#N

InChI

InChI=1S/C12H8ClN3S/c1-17-12-9(7-14)10(13)15-11(16-12)8-5-3-2-4-6-8/h2-6H,1H3