S-methyl 3-(2,4-dichlorophenyl)-2-imidazol-1-yl-butanethioate

Systemtic Name: S-methyl 3-(2,4-dichlorophenyl)-2-imidazol-1-yl-butanethioate Openeye Name: S-methyl 3-(2,4-dichlorophenyl)-2-imidazol-1-yl-butanethioate CAS Name: 3-(2,4-dichlorophenyl)-2-(1-imidazolyl)butanethioic acid S-methyl ester IUPAC Name: S-methyl 3-(2,4-dichlorophenyl)-2-imidazol-1-ylbutanethioate Traditional Name: 3-(2,4-dichlorophenyl)-2-imidazol-1-yl-butanethioic acid S-methyl ester Formula: C14H14Cl2N2OS MolecularWeight: 329.24476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)Cl)Cl)C(C(=O)SC)N2C=CN=C2

Isomeric SMILES

CC(C1=C(C=C(C=C1)Cl)Cl)C(C(=O)SC)N2C=CN=C2

InChI

InChI=1S/C14H14Cl2N2OS/c1-9(11-4-3-10(15)7-12(11)16)13(14(19)20-2)18-6-5-17-8-18/h3-9,13H,1-2H3