O-propyl [2-imidazol-1-yl-1-[2,4,6-tris(chloranyl)phenyl]ethyl]sulfanylmethanethioate

Systemtic Name: O-propyl [2-imidazol-1-yl-1-[2,4,6-tris(chloranyl)phenyl]ethyl]sulfanylmethanethioate Openeye Name: O-propyl [2-imidazol-1-yl-1-(2,4,6-trichlorophenyl)ethyl]sulfanylmethanethioate CAS Name: [[2-(1-imidazolyl)-1-(2,4,6-trichlorophenyl)ethyl]thio]methanethioic acid O-propyl ester IUPAC Name: O-propyl [2-imidazol-1-yl-1-(2,4,6-trichlorophenyl)ethyl]sulfanylmethanethioate Traditional Name: [[2-imidazol-1-yl-1-(2,4,6-trichlorophenyl)ethyl]thio]methanethioic acid O-propyl ester Formula: C15H15Cl3N2OS2 MolecularWeight: 409.7814

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=S)SC(CN1C=CN=C1)C2=C(C=C(C=C2Cl)Cl)Cl

Isomeric SMILES

CCCOC(=S)SC(CN1C=CN=C1)C2=C(C=C(C=C2Cl)Cl)Cl

InChI

InChI=1S/C15H15Cl3N2OS2/c1-2-5-21-15(22)23-13(8-20-4-3-19-9-20)14-11(17)6-10(16)7-12(14)18/h3-4,6-7,9,13H,2,5,8H2,1H3