1-[3-[(4-chlorophenyl)methylsulfanyl]octyl]imidazole

Systemtic Name: 1-[3-[(4-chlorophenyl)methylsulfanyl]octyl]imidazole Openeye Name: 1-[3-[(4-chlorophenyl)methylsulfanyl]octyl]imidazole CAS Name: 1-[3-[(4-chlorophenyl)methylthio]octyl]imidazole IUPAC Name: 1-[3-[(4-chlorophenyl)methylsulfanyl]octyl]imidazole Traditional Name: 1-[3-[(4-chlorobenzyl)thio]octyl]imidazole Formula: C18H25ClN2S MolecularWeight: 336.9225

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCN1C=CN=C1)SCC2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCCC(CCN1C=CN=C1)SCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H25ClN2S/c1-2-3-4-5-18(10-12-21-13-11-20-15-21)22-14-16-6-8-17(19)9-7-16/h6-9,11,13,15,18H,2-5,10,12,14H2,1H3