2-(4-chloranyl-6-phenyl-pyrimidin-2-yl)sulfanylethanenitrile

Systemtic Name: 2-(4-chloranyl-6-phenyl-pyrimidin-2-yl)sulfanylethanenitrile Openeye Name: 2-(4-chloro-6-phenyl-pyrimidin-2-yl)sulfanylacetonitrile CAS Name: 2-[(4-chloro-6-phenyl-2-pyrimidinyl)thio]acetonitrile IUPAC Name: 2-(4-chloro-6-phenylpyrimidin-2-yl)sulfanylacetonitrile Traditional Name: 2-[(4-chloro-6-phenyl-pyrimidin-2-yl)thio]acetonitrile Formula: C12H8ClN3S MolecularWeight: 261.73002

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NC(=N2)SCC#N)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NC(=N2)SCC#N)Cl

InChI

InChI=1S/C12H8ClN3S/c13-11-8-10(9-4-2-1-3-5-9)15-12(16-11)17-7-6-14/h1-5,8H,7H2