1,2-bis(butylsulfanyl)cyclohexa-3,5-diene-1,2-dicarbonitrile

Systemtic Name: 1,2-bis(butylsulfanyl)cyclohexa-3,5-diene-1,2-dicarbonitrile Openeye Name: 1,2-bis(butylsulfanyl)cyclohexa-3,5-diene-1,2-dicarbonitrile CAS Name: 1,2-bis(butylthio)cyclohexa-3,5-diene-1,2-dicarbonitrile IUPAC Name: 1,2-bis(butylsulfanyl)cyclohexa-3,5-diene-1,2-dicarbonitrile Traditional Name: 1,2-bis(butylthio)cyclohexa-3,5-diene-1,2-dicarbonitrile Formula: C16H22N2S2 MolecularWeight: 306.48928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1(C=CC=CC1(C#N)SCCCC)C#N

Isomeric SMILES

CCCCSC1(C=CC=CC1(C#N)SCCCC)C#N

InChI

InChI=1S/C16H22N2S2/c1-3-5-11-19-15(13-17)9-7-8-10-16(15,14-18)20-12-6-4-2/h7-10H,3-6,11-12H2,1-2H3