4-(2-chlorophenyl)-6-methylsulfanyl-2-pyrazin-2-yl-pyrimidine-5-carbonitrile

Systemtic Name: 4-(2-chlorophenyl)-6-methylsulfanyl-2-pyrazin-2-yl-pyrimidine-5-carbonitrile Openeye Name: 4-(2-chlorophenyl)-6-methylsulfanyl-2-pyrazin-2-yl-pyrimidine-5-carbonitrile CAS Name: 4-(2-chlorophenyl)-6-(methylthio)-2-(2-pyrazinyl)-5-pyrimidinecarbonitrile IUPAC Name: 4-(2-chlorophenyl)-6-methylsulfanyl-2-pyrazin-2-ylpyrimidine-5-carbonitrile Traditional Name: 4-(2-chlorophenyl)-6-(methylthio)-2-pyrazin-2-yl-pyrimidine-5-carbonitrile Formula: C16H10ClN5S MolecularWeight: 339.8021

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NC(=C1C#N)C2=CC=CC=C2Cl)C3=NC=CN=C3

Isomeric SMILES

CSC1=NC(=NC(=C1C#N)C2=CC=CC=C2Cl)C3=NC=CN=C3

InChI

InChI=1S/C16H10ClN5S/c1-23-16-11(8-18)14(10-4-2-3-5-12(10)17)21-15(22-16)13-9-19-6-7-20-13/h2-7,9H,1H3