4-(1-heptylsulfanyl-2-imidazol-1-yl-ethyl)benzenecarbonitrile

Systemtic Name: 4-(1-heptylsulfanyl-2-imidazol-1-yl-ethyl)benzenecarbonitrile Openeye Name: 4-(1-heptylsulfanyl-2-imidazol-1-yl-ethyl)benzonitrile CAS Name: 4-[1-(heptylthio)-2-(1-imidazolyl)ethyl]benzonitrile IUPAC Name: 4-(1-heptylsulfanyl-2-imidazol-1-ylethyl)benzonitrile Traditional Name: 4-[1-(heptylthio)-2-imidazol-1-yl-ethyl]benzonitrile Formula: C19H25N3S MolecularWeight: 327.4869

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCSC(CN1C=CN=C1)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCCCCSC(CN1C=CN=C1)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C19H25N3S/c1-2-3-4-5-6-13-23-19(15-22-12-11-21-16-22)18-9-7-17(14-20)8-10-18/h7-12,16,19H,2-6,13,15H2,1H3