2-(3-methylnaphtho[1,2-b][1]benzothiol-6-yl)ethanenitrile

Systemtic Name: 2-(3-methylnaphtho[1,2-b][1]benzothiol-6-yl)ethanenitrile Openeye Name: 2-(3-methylnaphtho[1,2-b]benzothiophen-6-yl)acetonitrile CAS Name: 2-(3-methyl-6-naphtho[1,2-b][1]benzothiolyl)acetonitrile IUPAC Name: 2-(3-methylnaphtho[1,2-b][1]benzothiol-6-yl)acetonitrile Traditional Name: 2-(3-methylnaphtho[1,2-b]benzothiophen-6-yl)acetonitrile Formula: C19H13NS MolecularWeight: 287.37822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C3C4=CC=CC=C4SC3=C2C=C1)CC#N

Isomeric SMILES

CC1=CC2=CC(=C3C4=CC=CC=C4SC3=C2C=C1)CC#N

InChI

InChI=1S/C19H13NS/c1-12-6-7-15-14(10-12)11-13(8-9-20)18-16-4-2-3-5-17(16)21-19(15)18/h2-7,10-11H,8H2,1H3