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

Systemtic Name: 1-[3-[(4-chlorophenyl)methylsulfanyl]heptyl]imidazole Openeye Name: 1-[3-[(4-chlorophenyl)methylsulfanyl]heptyl]imidazole CAS Name: 1-[3-[(4-chlorophenyl)methylthio]heptyl]imidazole IUPAC Name: 1-[3-[(4-chlorophenyl)methylsulfanyl]heptyl]imidazole Traditional Name: 1-[3-[(4-chlorobenzyl)thio]heptyl]imidazole Formula: C17H23ClN2S MolecularWeight: 322.89592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23ClN2S/c1-2-3-4-17(9-11-20-12-10-19-14-20)21-13-15-5-7-16(18)8-6-15/h5-8,10,12,14,17H,2-4,9,11,13H2,1H3