1-[(E)-3-[(4-chlorophenyl)methylsulfanyl]prop-2-enyl]imidazole

Systemtic Name: 1-[(E)-3-[(4-chlorophenyl)methylsulfanyl]prop-2-enyl]imidazole Openeye Name: 1-[(E)-3-[(4-chlorophenyl)methylsulfanyl]allyl]imidazole CAS Name: 1-[(E)-3-[(4-chlorophenyl)methylthio]prop-2-enyl]imidazole IUPAC Name: 1-[(E)-3-[(4-chlorophenyl)methylsulfanyl]prop-2-enyl]imidazole Traditional Name: 1-[(E)-3-[(4-chlorobenzyl)thio]allyl]imidazole Formula: C13H13ClN2S MolecularWeight: 264.77372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC=CCN2C=CN=C2)Cl

Isomeric SMILES

C1=CC(=CC=C1CS/C=C/CN2C=CN=C2)Cl

InChI

InChI=1S/C13H13ClN2S/c14-13-4-2-12(3-5-13)10-17-9-1-7-16-8-6-15-11-16/h1-6,8-9,11H,7,10H2/b9-1+