(2,4-dichlorophenyl)methyl 2-(2-cyanophenyl)sulfanylbenzoate

Systemtic Name: (2,4-dichlorophenyl)methyl 2-(2-cyanophenyl)sulfanylbenzoate Openeye Name: (2,4-dichlorophenyl)methyl 2-(2-cyanophenyl)sulfanylbenzoate CAS Name: 2-[(2-cyanophenyl)thio]benzoic acid (2,4-dichlorophenyl)methyl ester IUPAC Name: (2,4-dichlorophenyl)methyl 2-(2-cyanophenyl)sulfanylbenzoate Traditional Name: 2-[(2-cyanophenyl)thio]benzoic acid (2,4-dichlorobenzyl) ester Formula: C21H13Cl2NO2S MolecularWeight: 414.30442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)SC2=CC=CC=C2C(=O)OCC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C#N)SC2=CC=CC=C2C(=O)OCC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H13Cl2NO2S/c22-16-10-9-15(18(23)11-16)13-26-21(25)17-6-2-4-8-20(17)27-19-7-3-1-5-14(19)12-24/h1-11H,13H2