1-[2-octylsulfanyl-3-(phenylmethylsulfanyl)propyl]imidazole

Systemtic Name: 1-[2-octylsulfanyl-3-(phenylmethylsulfanyl)propyl]imidazole Openeye Name: 1-(3-benzylsulfanyl-2-octylsulfanyl-propyl)imidazole CAS Name: 1-[2-(octylthio)-3-(phenylmethylthio)propyl]imidazole IUPAC Name: 1-(3-benzylsulfanyl-2-octylsulfanylpropyl)imidazole Traditional Name: 1-[3-(benzylthio)-2-(octylthio)propyl]imidazole Formula: C21H32N2S2 MolecularWeight: 376.62218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC(CN1C=CN=C1)CSCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCSC(CN1C=CN=C1)CSCC2=CC=CC=C2

InChI

InChI=1S/C21H32N2S2/c1-2-3-4-5-6-10-15-25-21(16-23-14-13-22-19-23)18-24-17-20-11-8-7-9-12-20/h7-9,11-14,19,21H,2-6,10,15-18H2,1H3