copper O-ethyl 3-(2,4-dichlorophenyl)-2-imidazol-1-yl-butanethioate sulfate

Systemtic Name: copper O-ethyl 3-(2,4-dichlorophenyl)-2-imidazol-1-yl-butanethioate sulfate Openeye Name: copper O-ethyl 3-(2,4-dichlorophenyl)-2-imidazol-1-yl-butanethioate sulfate CAS Name: copper 3-(2,4-dichlorophenyl)-2-(1-imidazolyl)butanethioic acid O-ethyl ester sulfate IUPAC Name: copper O-ethyl 3-(2,4-dichlorophenyl)-2-imidazol-1-ylbutanethioate sulfate Traditional Name: cupric 3-(2,4-dichlorophenyl)-2-imidazol-1-yl-butanethioic acid O-ethyl ester sulfate Formula: C15H16Cl2CuN2O5S2 MolecularWeight: 502.87994

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=S)C(C(C)C1=C(C=C(C=C1)Cl)Cl)N2C=CN=C2.[O-]S(=O)(=O)[O-].[Cu+2]

Isomeric SMILES

CCOC(=S)C(C(C)C1=C(C=C(C=C1)Cl)Cl)N2C=CN=C2.[O-]S(=O)(=O)[O-].[Cu+2]

InChI

InChI=1S/C15H16Cl2N2OS.Cu.H2O4S/c1-3-20-15(21)14(19-7-6-18-9-19)10(2)12-5-4-11(16)8-13(12)17;;1-5(2,3)4/h4-10,14H,3H2,1-2H3;;(H2,1,2,3,4)/q;+2;/p-2