2-(3,4-dihydroisoquinolin-1-yl)-2-sulfanyl-ethanenitrile

Systemtic Name: 2-(3,4-dihydroisoquinolin-1-yl)-2-sulfanyl-ethanenitrile Openeye Name: 2-(3,4-dihydroisoquinolin-1-yl)-2-sulfanyl-acetonitrile CAS Name: 2-(3,4-dihydroisoquinolin-1-yl)-2-mercaptoacetonitrile IUPAC Name: 2-(3,4-dihydroisoquinolin-1-yl)-2-sulfanylacetonitrile Traditional Name: 2-(3,4-dihydroisoquinolin-1-yl)-2-mercapto-acetonitrile Formula: C11H10N2S MolecularWeight: 202.2755

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(C2=CC=CC=C21)C(C#N)S

Isomeric SMILES

C1CN=C(C2=CC=CC=C21)C(C#N)S

InChI

InChI=1S/C11H10N2S/c12-7-10(14)11-9-4-2-1-3-8(9)5-6-13-11/h1-4,10,14H,5-6H2