2-[[4-(2-methylphenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 2-[[4-(2-methylphenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 2-[[4-(o-tolyl)-5-thioxo-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzonitrile CAS Name: 2-[[[4-(2-methylphenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]thio]methyl]benzonitrile IUPAC Name: 2-[[4-(2-methylphenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzonitrile Traditional Name: 2-[[[4-(o-tolyl)-5-thioxo-1,3,4-thiadiazol-2-yl]thio]methyl]benzonitrile Formula: C17H13N3S3 MolecularWeight: 355.50022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=S)SC(=N2)SCC3=CC=CC=C3C#N

Isomeric SMILES

CC1=CC=CC=C1N2C(=S)SC(=N2)SCC3=CC=CC=C3C#N

InChI

InChI=1S/C17H13N3S3/c1-12-6-2-5-9-15(12)20-17(21)23-16(19-20)22-11-14-8-4-3-7-13(14)10-18/h2-9H,11H2,1H3