S-[2-imidazol-1-yl-1-[2,4,6-tris(chloranyl)phenyl]ethyl] propanethioate

Systemtic Name: S-[2-imidazol-1-yl-1-[2,4,6-tris(chloranyl)phenyl]ethyl] propanethioate Openeye Name: S-[2-imidazol-1-yl-1-(2,4,6-trichlorophenyl)ethyl] propanethioate CAS Name: propanethioic acid S-[2-(1-imidazolyl)-1-(2,4,6-trichlorophenyl)ethyl] ester IUPAC Name: S-[2-imidazol-1-yl-1-(2,4,6-trichlorophenyl)ethyl] propanethioate Traditional Name: propanethioic acid S-[2-imidazol-1-yl-1-(2,4,6-trichlorophenyl)ethyl] ester Formula: C14H13Cl3N2OS MolecularWeight: 363.68982

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)SC(CN1C=CN=C1)C2=C(C=C(C=C2Cl)Cl)Cl

Isomeric SMILES

CCC(=O)SC(CN1C=CN=C1)C2=C(C=C(C=C2Cl)Cl)Cl

InChI

InChI=1S/C14H13Cl3N2OS/c1-2-13(20)21-12(7-19-4-3-18-8-19)14-10(16)5-9(15)6-11(14)17/h3-6,8,12H,2,7H2,1H3