[2-oxidanylidene-2-[2-(phenylmethylsulfanyl)ethylamino]ethyl] 2-[(2-methoxyphenyl)carbonylamino]ethanoate

Systemtic Name: [2-oxidanylidene-2-[2-(phenylmethylsulfanyl)ethylamino]ethyl] 2-[(2-methoxyphenyl)carbonylamino]ethanoate Openeye Name: [2-(2-benzylsulfanylethylamino)-2-oxo-ethyl] 2-[(2-methoxybenzoyl)amino]acetate CAS Name: 2-[[(2-methoxyphenyl)-oxomethyl]amino]acetic acid [2-oxo-2-[2-(phenylmethylthio)ethylamino]ethyl] ester IUPAC Name: [2-(2-benzylsulfanylethylamino)-2-oxoethyl] 2-[(2-methoxybenzoyl)amino]acetate Traditional Name: 2-(o-anisoylamino)acetic acid [2-[2-(benzylthio)ethylamino]-2-keto-ethyl] ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NCC(=O)OCC(=O)NCCSCC2=CC=CC=C2

Isomeric SMILES

COC1=CC=CC=C1C(=O)NCC(=O)OCC(=O)NCCSCC2=CC=CC=C2

InChI

InChI=1S/C21H24N2O5S/c1-27-18-10-6-5-9-17(18)21(26)23-13-20(25)28-14-19(24)22-11-12-29-15-16-7-3-2-4-8-16/h2-10H,11-15H2,1H3,(H,22,24)(H,23,26)