[2-[[4-[(2-methoxyphenyl)carbamoyl]phenyl]amino]-2-oxidanylidene-ethyl] 3-phenylsulfanylpropanoate

Systemtic Name: [2-[[4-[(2-methoxyphenyl)carbamoyl]phenyl]amino]-2-oxidanylidene-ethyl] 3-phenylsulfanylpropanoate Openeye Name: [2-[4-[(2-methoxyphenyl)carbamoyl]anilino]-2-oxo-ethyl] 3-phenylsulfanylpropanoate CAS Name: 3-(phenylthio)propanoic acid [2-[4-[(2-methoxyanilino)-oxomethyl]anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-[(2-methoxyphenyl)carbamoyl]anilino]-2-oxoethyl] 3-phenylsulfanylpropanoate Traditional Name: 3-(phenylthio)propionic acid [2-keto-2-[4-[(2-methoxyphenyl)carbamoyl]anilino]ethyl] ester Formula: C25H24N2O5S MolecularWeight: 464.53346

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)NC(=O)COC(=O)CCSC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)NC(=O)COC(=O)CCSC3=CC=CC=C3

InChI

InChI=1S/C25H24N2O5S/c1-31-22-10-6-5-9-21(22)27-25(30)18-11-13-19(14-12-18)26-23(28)17-32-24(29)15-16-33-20-7-3-2-4-8-20/h2-14H,15-17H2,1H3,(H,26,28)(H,27,30)