[2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 2-benzamido-2-phenyl-ethanoate

Systemtic Name: [2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 2-benzamido-2-phenyl-ethanoate Openeye Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 2-benzamido-2-phenyl-acetate CAS Name: 2-benzamido-2-phenylacetic acid [2-oxo-2-[3-(phenylthio)propylamino]ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 2-benzamido-2-phenylacetate Traditional Name: 2-benzamido-2-phenyl-acetic acid [2-keto-2-[3-(phenylthio)propylamino]ethyl] ester Formula: C26H26N2O4S MolecularWeight: 462.56064

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)OCC(=O)NCCCSC2=CC=CC=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)OCC(=O)NCCCSC2=CC=CC=C2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C26H26N2O4S/c29-23(27-17-10-18-33-22-15-8-3-9-16-22)19-32-26(31)24(20-11-4-1-5-12-20)28-25(30)21-13-6-2-7-14-21/h1-9,11-16,24H,10,17-19H2,(H,27,29)(H,28,30)