2-(6-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)-2-quinolin-2-yl-ethanenitrile

Systemtic Name: 2-(6-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)-2-quinolin-2-yl-ethanenitrile Openeye Name: 2-(6-chloro-2-methylsulfanyl-pyrimidin-4-yl)-2-(2-quinolyl)acetonitrile CAS Name: 2-[6-chloro-2-(methylthio)-4-pyrimidinyl]-2-(2-quinolinyl)acetonitrile IUPAC Name: 2-(6-chloro-2-methylsulfanylpyrimidin-4-yl)-2-quinolin-2-ylacetonitrile Traditional Name: 2-[6-chloro-2-(methylthio)pyrimidin-4-yl]-2-(2-quinolyl)acetonitrile Formula: C16H11ClN4S MolecularWeight: 326.80334

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=CC(=N1)Cl)C(C#N)C2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CSC1=NC(=CC(=N1)Cl)C(C#N)C2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C16H11ClN4S/c1-22-16-20-14(8-15(17)21-16)11(9-18)13-7-6-10-4-2-3-5-12(10)19-13/h2-8,11H,1H3