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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSCC(CN1C=CN=C1)SCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCSCC(CN1C=CN=C1)SCC2=CC=CC=C2

InChI

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