methyl 2-[4-[2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethoxy]phenyl]ethanoate

Systemtic Name: methyl 2-[4-[2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethoxy]phenyl]ethanoate Openeye Name: methyl 2-[4-[2-oxo-2-(3-phenylsulfanylpropylamino)ethoxy]phenyl]acetate CAS Name: 2-[4-[2-oxo-2-[3-(phenylthio)propylamino]ethoxy]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[2-oxo-2-(3-phenylsulfanylpropylamino)ethoxy]phenyl]acetate Traditional Name: 2-[4-[2-keto-2-[3-(phenylthio)propylamino]ethoxy]phenyl]acetic acid methyl ester Formula: C20H23NO4S MolecularWeight: 373.46592

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC=C(C=C1)OCC(=O)NCCCSC2=CC=CC=C2

Isomeric SMILES

COC(=O)CC1=CC=C(C=C1)OCC(=O)NCCCSC2=CC=CC=C2

InChI

InChI=1S/C20H23NO4S/c1-24-20(23)14-16-8-10-17(11-9-16)25-15-19(22)21-12-5-13-26-18-6-3-2-4-7-18/h2-4,6-11H,5,12-15H2,1H3,(H,21,22)