[4-(4-cyanophenyl)phenyl] 2-phenylsulfanylethanoate

Systemtic Name: [4-(4-cyanophenyl)phenyl] 2-phenylsulfanylethanoate Openeye Name: [4-(4-cyanophenyl)phenyl] 2-phenylsulfanylacetate CAS Name: 2-(phenylthio)acetic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 2-phenylsulfanylacetate Traditional Name: 2-(phenylthio)acetic acid [4-(4-cyanophenyl)phenyl] ester Formula: C21H15NO2S MolecularWeight: 345.4143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)SCC(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H15NO2S/c22-14-16-6-8-17(9-7-16)18-10-12-19(13-11-18)24-21(23)15-25-20-4-2-1-3-5-20/h1-13H,15H2