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

Systemtic Name: 1-[(E)-4-(4-chlorophenyl)-2-heptylsulfanyl-but-3-enyl]imidazole Openeye Name: 1-[(E)-4-(4-chlorophenyl)-2-heptylsulfanyl-but-3-enyl]imidazole CAS Name: 1-[(E)-4-(4-chlorophenyl)-2-(heptylthio)but-3-enyl]imidazole IUPAC Name: 1-[(E)-4-(4-chlorophenyl)-2-heptylsulfanylbut-3-enyl]imidazole Traditional Name: 1-[(E)-4-(4-chlorophenyl)-2-(heptylthio)but-3-enyl]imidazole Formula: C20H27ClN2S MolecularWeight: 362.95978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27ClN2S/c1-2-3-4-5-6-15-24-20(16-23-14-13-22-17-23)12-9-18-7-10-19(21)11-8-18/h7-14,17,20H,2-6,15-16H2,1H3/b12-9+