2-[[2,5-dimethyl-3-[(2-methylphenyl)sulfanylmethyl]phenyl]methylidene]propanedinitrile

Systemtic Name: 2-[[2,5-dimethyl-3-[(2-methylphenyl)sulfanylmethyl]phenyl]methylidene]propanedinitrile Openeye Name: 2-[[2,5-dimethyl-3-(o-tolylsulfanylmethyl)phenyl]methylene]propanedinitrile CAS Name: 2-[[2,5-dimethyl-3-[[(2-methylphenyl)thio]methyl]phenyl]methylidene]propanedinitrile IUPAC Name: 2-[[2,5-dimethyl-3-[(2-methylphenyl)sulfanylmethyl]phenyl]methylidene]propanedinitrile Traditional Name: 2-[2,5-dimethyl-3-[(o-tolylthio)methyl]benzylidene]malononitrile Formula: C20H18N2S MolecularWeight: 318.43532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC2=C(C(=CC(=C2)C)C=C(C#N)C#N)C

Isomeric SMILES

CC1=CC=CC=C1SCC2=C(C(=CC(=C2)C)C=C(C#N)C#N)C

InChI

InChI=1S/C20H18N2S/c1-14-8-18(10-17(11-21)12-22)16(3)19(9-14)13-23-20-7-5-4-6-15(20)2/h4-10H,13H2,1-3H3