(4-cyanophenyl)methyl 2-(1,3-thiazol-4-ylmethylsulfanyl)benzoate

Systemtic Name: (4-cyanophenyl)methyl 2-(1,3-thiazol-4-ylmethylsulfanyl)benzoate Openeye Name: (4-cyanophenyl)methyl 2-(thiazol-4-ylmethylsulfanyl)benzoate CAS Name: 2-(4-thiazolylmethylthio)benzoic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 2-(1,3-thiazol-4-ylmethylsulfanyl)benzoate Traditional Name: 2-(thiazol-4-ylmethylthio)benzoic acid (4-cyanobenzyl) ester Formula: C19H14N2O2S2 MolecularWeight: 366.45666

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)OCC2=CC=C(C=C2)C#N)SCC3=CSC=N3

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)OCC2=CC=C(C=C2)C#N)SCC3=CSC=N3

InChI

InChI=1S/C19H14N2O2S2/c20-9-14-5-7-15(8-6-14)10-23-19(22)17-3-1-2-4-18(17)25-12-16-11-24-13-21-16/h1-8,11,13H,10,12H2