2-[[4-(2-methylphenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]ethanenitrile

Systemtic Name: 2-[[4-(2-methylphenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]ethanenitrile Openeye Name: 2-[[4-(o-tolyl)-5-thioxo-1,3,4-thiadiazol-2-yl]sulfanyl]acetonitrile CAS Name: 2-[[4-(2-methylphenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]thio]acetonitrile IUPAC Name: 2-[[4-(2-methylphenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]acetonitrile Traditional Name: 2-[[4-(o-tolyl)-5-thioxo-1,3,4-thiadiazol-2-yl]thio]acetonitrile Formula: C11H9N3S3 MolecularWeight: 279.40426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=S)SC(=N2)SCC#N

Isomeric SMILES

CC1=CC=CC=C1N2C(=S)SC(=N2)SCC#N

InChI

InChI=1S/C11H9N3S3/c1-8-4-2-3-5-9(8)14-11(15)17-10(13-14)16-7-6-12/h2-5H,7H2,1H3