2-(3-methanoylquinolin-2-yl)sulfanylethanenitrile

Systemtic Name: 2-(3-methanoylquinolin-2-yl)sulfanylethanenitrile Openeye Name: 2-[(3-formyl-2-quinolyl)sulfanyl]acetonitrile CAS Name: 2-[(3-formyl-2-quinolinyl)thio]acetonitrile IUPAC Name: 2-(3-formylquinolin-2-yl)sulfanylacetonitrile Traditional Name: 2-[(3-formyl-2-quinolyl)thio]acetonitrile Formula: C12H8N2OS MolecularWeight: 228.26972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=N2)SCC#N)C=O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=N2)SCC#N)C=O

InChI

InChI=1S/C12H8N2OS/c13-5-6-16-12-10(8-15)7-9-3-1-2-4-11(9)14-12/h1-4,7-8H,6H2