[1-cyano-2-(4-methylphenyl)ethyl] thiocyanate

Systemtic Name: [1-cyano-2-(4-methylphenyl)ethyl] thiocyanate Openeye Name: [1-cyano-2-(p-tolyl)ethyl] thiocyanate CAS Name: thiocyanic acid [1-cyano-2-(4-methylphenyl)ethyl] ester IUPAC Name: [1-cyano-2-(4-methylphenyl)ethyl] thiocyanate Traditional Name: thiocyanic acid [1-cyano-2-(p-tolyl)ethyl] ester Formula: C11H10N2S MolecularWeight: 202.2755

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(C#N)SC#N

Isomeric SMILES

CC1=CC=C(C=C1)CC(C#N)SC#N

InChI

InChI=1S/C11H10N2S/c1-9-2-4-10(5-3-9)6-11(7-12)14-8-13/h2-5,11H,6H2,1H3