[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 2-[(4-ethoxyphenyl)carbonylamino]ethanoate

Systemtic Name: [2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 2-[(4-ethoxyphenyl)carbonylamino]ethanoate Openeye Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 2-[(4-ethoxybenzoyl)amino]acetate CAS Name: 2-[[(4-ethoxyphenyl)-oxomethyl]amino]acetic acid [2-oxo-2-[2-(phenylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 2-[(4-ethoxybenzoyl)amino]acetate Traditional Name: 2-[(4-ethoxybenzoyl)amino]acetic acid [2-keto-2-[2-(phenylthio)ethylamino]ethyl] ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NCC(=O)OCC(=O)NCCSC2=CC=CC=C2

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NCC(=O)OCC(=O)NCCSC2=CC=CC=C2

InChI

InChI=1S/C21H24N2O5S/c1-2-27-17-10-8-16(9-11-17)21(26)23-14-20(25)28-15-19(24)22-12-13-29-18-6-4-3-5-7-18/h3-11H,2,12-15H2,1H3,(H,22,24)(H,23,26)