(2-oxidanylidene-2-phenylazanyl-ethyl) (2R)-2-[(2-methoxyphenyl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) (2R)-2-[(2-methoxyphenyl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: (2-anilino-2-oxo-ethyl) (2R)-2-[(2-methoxybenzoyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[(2-methoxyphenyl)-oxomethyl]amino]-4-(methylthio)butanoic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) (2R)-2-[(2-methoxybenzoyl)amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-4-(methylthio)-2-(o-anisoylamino)butyric acid (2-anilino-2-keto-ethyl) ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)OCC(=O)NC2=CC=CC=C2

Isomeric SMILES

COC1=CC=CC=C1C(=O)N[C@H](CCSC)C(=O)OCC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C21H24N2O5S/c1-27-18-11-7-6-10-16(18)20(25)23-17(12-13-29-2)21(26)28-14-19(24)22-15-8-4-3-5-9-15/h3-11,17H,12-14H2,1-2H3,(H,22,24)(H,23,25)/t17-/m1/s1