(2R)-2-[[2-[(4-methoxyphenyl)carbonylamino]phenyl]carbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: (2R)-2-[[2-[(4-methoxyphenyl)carbonylamino]phenyl]carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: (2R)-2-[[2-[(4-methoxybenzoyl)amino]benzoyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: (2R)-2-[[[2-[[(4-methoxyphenyl)-oxomethyl]amino]phenyl]-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: (2R)-2-[[2-[(4-methoxybenzoyl)amino]benzoyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: (2R)-4-(methylthio)-2-[[2-(p-anisoylamino)benzoyl]amino]butyric acid Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)NC(CCSC)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)N[C@H](CCSC)C(=O)O

InChI

InChI=1S/C20H22N2O5S/c1-27-14-9-7-13(8-10-14)18(23)21-16-6-4-3-5-15(16)19(24)22-17(20(25)26)11-12-28-2/h3-10,17H,11-12H2,1-2H3,(H,21,23)(H,22,24)(H,25,26)/t17-/m1/s1