6-(4-chlorophenyl)-2-ethylsulfanyl-4-oxidanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 6-(4-chlorophenyl)-2-ethylsulfanyl-4-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 6-(4-chlorophenyl)-2-ethylsulfanyl-4-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 6-(4-chlorophenyl)-2-(ethylthio)-4-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-(4-chlorophenyl)-2-ethylsulfanyl-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 6-(4-chlorophenyl)-2-(ethylthio)-4-keto-1H-pyrimidine-5-carbonitrile Formula: C13H10ClN3OS MolecularWeight: 291.756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC(=O)C(=C(N1)C2=CC=C(C=C2)Cl)C#N

Isomeric SMILES

CCSC1=NC(=O)C(=C(N1)C2=CC=C(C=C2)Cl)C#N

InChI

InChI=1S/C13H10ClN3OS/c1-2-19-13-16-11(10(7-15)12(18)17-13)8-3-5-9(14)6-4-8/h3-6H,2H2,1H3,(H,16,17,18)