2,4-bis(phenylmethylsulfanyl)benzenecarbonitrile

Systemtic Name: 2,4-bis(phenylmethylsulfanyl)benzenecarbonitrile Openeye Name: 2,4-bis(benzylsulfanyl)benzonitrile CAS Name: 2,4-bis(phenylmethylthio)benzonitrile IUPAC Name: 2,4-bis(benzylsulfanyl)benzonitrile Traditional Name: 2,4-bis(benzylthio)benzonitrile Formula: C21H17NS2 MolecularWeight: 347.49638

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=CC(=C(C=C2)C#N)SCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CSC2=CC(=C(C=C2)C#N)SCC3=CC=CC=C3

InChI

InChI=1S/C21H17NS2/c22-14-19-11-12-20(23-15-17-7-3-1-4-8-17)13-21(19)24-16-18-9-5-2-6-10-18/h1-13H,15-16H2