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

Systemtic Name: S-[2-imidazol-1-yl-1-[2,4,6-tris(chloranyl)phenyl]ethyl] butanethioate Openeye Name: S-[2-imidazol-1-yl-1-(2,4,6-trichlorophenyl)ethyl] butanethioate CAS Name: butanethioic 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] butanethioate Traditional Name: butanethioic acid S-[2-imidazol-1-yl-1-(2,4,6-trichlorophenyl)ethyl] ester Formula: C15H15Cl3N2OS MolecularWeight: 377.7164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15Cl3N2OS/c1-2-3-14(21)22-13(8-20-5-4-19-9-20)15-11(17)6-10(16)7-12(15)18/h4-7,9,13H,2-3,8H2,1H3