[2-[(2,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] (2S)-3-methyl-2-(thiophen-2-ylcarbonylamino)butanoate

Systemtic Name: [2-[(2,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] (2S)-3-methyl-2-(thiophen-2-ylcarbonylamino)butanoate Openeye Name: [2-(2,5-dimethoxyanilino)-2-oxo-ethyl] (2S)-3-methyl-2-(thiophene-2-carbonylamino)butanoate CAS Name: (2S)-3-methyl-2-[[oxo(thiophen-2-yl)methyl]amino]butanoic acid [2-(2,5-dimethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethoxyanilino)-2-oxoethyl] (2S)-3-methyl-2-(thiophene-2-carbonylamino)butanoate Traditional Name: (2S)-3-methyl-2-(2-thenoylamino)butyric acid [2-(2,5-dimethoxyanilino)-2-keto-ethyl] ester Formula: C20H24N2O6S MolecularWeight: 420.47936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)NC1=C(C=CC(=C1)OC)OC)NC(=O)C2=CC=CS2

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC(=O)NC1=C(C=CC(=C1)OC)OC)NC(=O)C2=CC=CS2

InChI

InChI=1S/C20H24N2O6S/c1-12(2)18(22-19(24)16-6-5-9-29-16)20(25)28-11-17(23)21-14-10-13(26-3)7-8-15(14)27-4/h5-10,12,18H,11H2,1-4H3,(H,21,23)(H,22,24)/t18-/m0/s1