methyl 2-[[4-(2-cyanophenyl)phenyl]methylsulfanyl]ethanoate

Systemtic Name: methyl 2-[[4-(2-cyanophenyl)phenyl]methylsulfanyl]ethanoate Openeye Name: methyl 2-[[4-(2-cyanophenyl)phenyl]methylsulfanyl]acetate CAS Name: 2-[[4-(2-cyanophenyl)phenyl]methylthio]acetic acid methyl ester IUPAC Name: methyl 2-[[4-(2-cyanophenyl)phenyl]methylsulfanyl]acetate Traditional Name: 2-[[4-(2-cyanophenyl)benzyl]thio]acetic acid methyl ester Formula: C17H15NO2S MolecularWeight: 297.3715

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSCC1=CC=C(C=C1)C2=CC=CC=C2C#N

Isomeric SMILES

COC(=O)CSCC1=CC=C(C=C1)C2=CC=CC=C2C#N

InChI

InChI=1S/C17H15NO2S/c1-20-17(19)12-21-11-13-6-8-14(9-7-13)16-5-3-2-4-15(16)10-18/h2-9H,11-12H2,1H3