[2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 2-[(4-methoxyphenyl)carbonylamino]ethanoate

Systemtic Name: [2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 2-[(4-methoxyphenyl)carbonylamino]ethanoate Openeye Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 2-[(4-methoxybenzoyl)amino]acetate CAS Name: 2-[[(4-methoxyphenyl)-oxomethyl]amino]acetic acid [2-oxo-2-[3-(phenylthio)propylamino]ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 2-[(4-methoxybenzoyl)amino]acetate Traditional Name: 2-(p-anisoylamino)acetic acid [2-keto-2-[3-(phenylthio)propylamino]ethyl] ester Formula: C21H24N2O5S MolecularWeight: 416.49066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NCC(=O)OCC(=O)NCCCSC2=CC=CC=C2

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NCC(=O)OCC(=O)NCCCSC2=CC=CC=C2

InChI

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