4-pentylsulfanylbenzenecarbonitrile

Systemtic Name: 4-pentylsulfanylbenzenecarbonitrile Openeye Name: 4-pentylsulfanylbenzonitrile CAS Name: 4-(pentylthio)benzonitrile IUPAC Name: 4-pentylsulfanylbenzonitrile Traditional Name: 4-(amylthio)benzonitrile Formula: C12H15NS MolecularWeight: 205.3192

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=CC=C(C=C1)C#N

Isomeric SMILES

CCCCCSC1=CC=C(C=C1)C#N

InChI

InChI=1S/C12H15NS/c1-2-3-4-9-14-12-7-5-11(10-13)6-8-12/h5-8H,2-4,9H2,1H3