1-[(E)-4-(4-chlorophenyl)-2-octylsulfanyl-but-3-enyl]imidazole

Systemtic Name: 1-[(E)-4-(4-chlorophenyl)-2-octylsulfanyl-but-3-enyl]imidazole Openeye Name: 1-[(E)-4-(4-chlorophenyl)-2-octylsulfanyl-but-3-enyl]imidazole CAS Name: 1-[(E)-4-(4-chlorophenyl)-2-(octylthio)but-3-enyl]imidazole IUPAC Name: 1-[(E)-4-(4-chlorophenyl)-2-octylsulfanylbut-3-enyl]imidazole Traditional Name: 1-[(E)-4-(4-chlorophenyl)-2-(octylthio)but-3-enyl]imidazole Formula: C21H29ClN2S MolecularWeight: 376.98636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC(CN1C=CN=C1)C=CC2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCCCCCSC(CN1C=CN=C1)/C=C/C2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H29ClN2S/c1-2-3-4-5-6-7-16-25-21(17-24-15-14-23-18-24)13-10-19-8-11-20(22)12-9-19/h8-15,18,21H,2-7,16-17H2,1H3/b13-10+