2-benzo[g][1]benzothiol-4-ylethanenitrile

Systemtic Name: 2-benzo[g][1]benzothiol-4-ylethanenitrile Openeye Name: 2-benzo[g]benzothiophen-4-ylacetonitrile CAS Name: 2-(4-benzo[g][1]benzothiolyl)acetonitrile IUPAC Name: 2-benzo[g][1]benzothiol-4-ylacetonitrile Traditional Name: 2-benzo[g]benzothiophen-4-ylacetonitrile Formula: C14H9NS MolecularWeight: 223.29296

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C3=C2SC=C3)CC#N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C3=C2SC=C3)CC#N

InChI

InChI=1S/C14H9NS/c15-7-5-11-9-10-3-1-2-4-12(10)14-13(11)6-8-16-14/h1-4,6,8-9H,5H2