1-(2-octylsulfanyl-4-phenyl-butyl)imidazole

Systemtic Name: 1-(2-octylsulfanyl-4-phenyl-butyl)imidazole Openeye Name: 1-(2-octylsulfanyl-4-phenyl-butyl)imidazole CAS Name: 1-[2-(octylthio)-4-phenylbutyl]imidazole IUPAC Name: 1-(2-octylsulfanyl-4-phenylbutyl)imidazole Traditional Name: 1-[2-(octylthio)-4-phenyl-butyl]imidazole Formula: C21H32N2S MolecularWeight: 344.55718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC(CCC1=CC=CC=C1)CN2C=CN=C2

Isomeric SMILES

CCCCCCCCSC(CCC1=CC=CC=C1)CN2C=CN=C2

InChI

InChI=1S/C21H32N2S/c1-2-3-4-5-6-10-17-24-21(18-23-16-15-22-19-23)14-13-20-11-8-7-9-12-20/h7-9,11-12,15-16,19,21H,2-6,10,13-14,17-18H2,1H3