O-octyl [1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl]sulfanylmethanethioate

Systemtic Name: O-octyl [1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl]sulfanylmethanethioate Openeye Name: O-octyl [1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl]sulfanylmethanethioate CAS Name: [[1-(2,4-dichlorophenyl)-2-(1-imidazolyl)ethyl]thio]methanethioic acid O-octyl ester IUPAC Name: O-octyl [1-(2,4-dichlorophenyl)-2-imidazol-1-ylethyl]sulfanylmethanethioate Traditional Name: [[1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl]thio]methanethioic acid O-octyl ester Formula: C20H26Cl2N2OS2 MolecularWeight: 445.46924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=S)SC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCCCCCCCOC(=S)SC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C20H26Cl2N2OS2/c1-2-3-4-5-6-7-12-25-20(26)27-19(14-24-11-10-23-15-24)17-9-8-16(21)13-18(17)22/h8-11,13,15,19H,2-7,12,14H2,1H3