methyl 2-[3-[[3-(4-cyanophenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methylsulfanyl]phenyl]ethanoate

Systemtic Name: methyl 2-[3-[[3-(4-cyanophenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methylsulfanyl]phenyl]ethanoate Openeye Name: methyl 2-[3-[[3-(4-cyanophenyl)-2-oxo-oxazolidin-5-yl]methylsulfanyl]phenyl]acetate CAS Name: 2-[3-[[3-(4-cyanophenyl)-2-oxo-5-oxazolidinyl]methylthio]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-[[3-(4-cyanophenyl)-2-oxo-1,3-oxazolidin-5-yl]methylsulfanyl]phenyl]acetate Traditional Name: 2-[3-[[3-(4-cyanophenyl)-2-keto-oxazolidin-5-yl]methylthio]phenyl]acetic acid methyl ester Formula: C20H18N2O4S MolecularWeight: 382.43292

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=CC=C1)SCC2CN(C(=O)O2)C3=CC=C(C=C3)C#N

Isomeric SMILES

COC(=O)CC1=CC(=CC=C1)SCC2CN(C(=O)O2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H18N2O4S/c1-25-19(23)10-15-3-2-4-18(9-15)27-13-17-12-22(20(24)26-17)16-7-5-14(11-21)6-8-16/h2-9,17H,10,12-13H2,1H3