2-(8-ethyl-2-methyl-quinolin-4-yl)sulfanylethanenitrile

Systemtic Name: 2-(8-ethyl-2-methyl-quinolin-4-yl)sulfanylethanenitrile Openeye Name: 2-[(8-ethyl-2-methyl-4-quinolyl)sulfanyl]acetonitrile CAS Name: 2-[(8-ethyl-2-methyl-4-quinolinyl)thio]acetonitrile IUPAC Name: 2-(8-ethyl-2-methylquinolin-4-yl)sulfanylacetonitrile Traditional Name: 2-[(8-ethyl-2-methyl-4-quinolyl)thio]acetonitrile Formula: C14H14N2S MolecularWeight: 242.33936

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1N=C(C=C2SCC#N)C

Isomeric SMILES

CCC1=CC=CC2=C1N=C(C=C2SCC#N)C

InChI

InChI=1S/C14H14N2S/c1-3-11-5-4-6-12-13(17-8-7-15)9-10(2)16-14(11)12/h4-6,9H,3,8H2,1-2H3