2-(4,6-dimethylquinolin-2-yl)sulfanylethanenitrile

Systemtic Name: 2-(4,6-dimethylquinolin-2-yl)sulfanylethanenitrile Openeye Name: 2-[(4,6-dimethyl-2-quinolyl)sulfanyl]acetonitrile CAS Name: 2-[(4,6-dimethyl-2-quinolinyl)thio]acetonitrile IUPAC Name: 2-(4,6-dimethylquinolin-2-yl)sulfanylacetonitrile Traditional Name: 2-[(4,6-dimethyl-2-quinolyl)thio]acetonitrile Formula: C13H12N2S MolecularWeight: 228.31278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C)SCC#N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C)SCC#N

InChI

InChI=1S/C13H12N2S/c1-9-3-4-12-11(7-9)10(2)8-13(15-12)16-6-5-14/h3-4,7-8H,6H2,1-2H3