[2-oxidanylidene-2-[(2-prop-2-enylsulfanylphenyl)amino]ethyl] 5-(phenoxymethyl)furan-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(2-prop-2-enylsulfanylphenyl)amino]ethyl] 5-(phenoxymethyl)furan-2-carboxylate Openeye Name: [2-(2-allylsulfanylanilino)-2-oxo-ethyl] 5-(phenoxymethyl)furan-2-carboxylate CAS Name: 5-(phenoxymethyl)-2-furancarboxylic acid [2-oxo-2-[2-(prop-2-enylthio)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(2-prop-2-enylsulfanylanilino)ethyl] 5-(phenoxymethyl)furan-2-carboxylate Traditional Name: 5-(phenoxymethyl)furan-2-carboxylic acid [2-[2-(allylthio)anilino]-2-keto-ethyl] ester Formula: C23H21NO5S MolecularWeight: 423.48154

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=CC=CC=C1NC(=O)COC(=O)C2=CC=C(O2)COC3=CC=CC=C3

Isomeric SMILES

C=CCSC1=CC=CC=C1NC(=O)COC(=O)C2=CC=C(O2)COC3=CC=CC=C3

InChI

InChI=1S/C23H21NO5S/c1-2-14-30-21-11-7-6-10-19(21)24-22(25)16-28-23(26)20-13-12-18(29-20)15-27-17-8-4-3-5-9-17/h2-13H,1,14-16H2,(H,24,25)