(2E)-5,5-bis(methylsulfanyl)-3-phenyl-penta-2,4-dienenitrile

Systemtic Name: (2E)-5,5-bis(methylsulfanyl)-3-phenyl-penta-2,4-dienenitrile Openeye Name: (2E)-5,5-bis(methylsulfanyl)-3-phenyl-penta-2,4-dienenitrile CAS Name: (2E)-5,5-bis(methylthio)-3-phenylpenta-2,4-dienenitrile IUPAC Name: (2E)-5,5-bis(methylsulfanyl)-3-phenylpenta-2,4-dienenitrile Traditional Name: (2E)-5,5-bis(methylthio)-3-phenyl-penta-2,4-dienenitrile Formula: C13H13NS2 MolecularWeight: 247.37902

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=CC(=CC#N)C1=CC=CC=C1)SC

Isomeric SMILES

CSC(=C/C(=C\C#N)/C1=CC=CC=C1)SC

InChI

InChI=1S/C13H13NS2/c1-15-13(16-2)10-12(8-9-14)11-6-4-3-5-7-11/h3-8,10H,1-2H3/b12-8+