2-ethanoylsulfanylethyl 2-[3-(phenethylcarbamoylamino)phenyl]ethanoate

Systemtic Name: 2-ethanoylsulfanylethyl 2-[3-(phenethylcarbamoylamino)phenyl]ethanoate Openeye Name: 2-acetylsulfanylethyl 2-[3-(phenethylcarbamoylamino)phenyl]acetate CAS Name: 2-[3-[[oxo-(phenethylamino)methyl]amino]phenyl]acetic acid 2-(acetylthio)ethyl ester IUPAC Name: 2-acetylsulfanylethyl 2-[3-(phenethylcarbamoylamino)phenyl]acetate Traditional Name: 2-[3-(phenethylcarbamoylamino)phenyl]acetic acid 2-(acetylthio)ethyl ester Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCOC(=O)CC1=CC(=CC=C1)NC(=O)NCCC2=CC=CC=C2

Isomeric SMILES

CC(=O)SCCOC(=O)CC1=CC(=CC=C1)NC(=O)NCCC2=CC=CC=C2

InChI

InChI=1S/C21H24N2O4S/c1-16(24)28-13-12-27-20(25)15-18-8-5-9-19(14-18)23-21(26)22-11-10-17-6-3-2-4-7-17/h2-9,14H,10-13,15H2,1H3,(H2,22,23,26)