1-[3-(4-chlorophenyl)-3-hexylsulfanyl-propyl]imidazole

Systemtic Name: 1-[3-(4-chlorophenyl)-3-hexylsulfanyl-propyl]imidazole Openeye Name: 1-[3-(4-chlorophenyl)-3-hexylsulfanyl-propyl]imidazole CAS Name: 1-[3-(4-chlorophenyl)-3-(hexylthio)propyl]imidazole IUPAC Name: 1-[3-(4-chlorophenyl)-3-hexylsulfanylpropyl]imidazole Traditional Name: 1-[3-(4-chlorophenyl)-3-(hexylthio)propyl]imidazole Formula: C18H25ClN2S MolecularWeight: 336.9225

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC(CCN1C=CN=C1)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCCCSC(CCN1C=CN=C1)C2=CC=C(C=C2)Cl

InChI

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