4-methylsulfanyl-6-phenyl-2-pyridin-3-yl-pyrimidine-5-carbonitrile

Systemtic Name: 4-methylsulfanyl-6-phenyl-2-pyridin-3-yl-pyrimidine-5-carbonitrile Openeye Name: 4-methylsulfanyl-6-phenyl-2-(3-pyridyl)pyrimidine-5-carbonitrile CAS Name: 4-(methylthio)-6-phenyl-2-(3-pyridinyl)-5-pyrimidinecarbonitrile IUPAC Name: 4-methylsulfanyl-6-phenyl-2-pyridin-3-ylpyrimidine-5-carbonitrile Traditional Name: 4-(methylthio)-6-phenyl-2-(3-pyridyl)pyrimidine-5-carbonitrile Formula: C17H12N4S MolecularWeight: 304.36898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12N4S/c1-22-17-14(10-18)15(12-6-3-2-4-7-12)20-16(21-17)13-8-5-9-19-11-13/h2-9,11H,1H3