4-hexadecylsulfanylbenzenecarbonitrile

Systemtic Name: 4-hexadecylsulfanylbenzenecarbonitrile Openeye Name: 4-hexadecylsulfanylbenzonitrile CAS Name: 4-(hexadecylthio)benzonitrile IUPAC Name: 4-hexadecylsulfanylbenzonitrile Traditional Name: 4-(cetylthio)benzonitrile Formula: C23H37NS MolecularWeight: 359.61158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSC1=CC=C(C=C1)C#N

Isomeric SMILES

CCCCCCCCCCCCCCCCSC1=CC=C(C=C1)C#N

InChI

InChI=1S/C23H37NS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-25-23-18-16-22(21-24)17-19-23/h16-19H,2-15,20H2,1H3