ethyl 4-(2-methylpropyl)-2-[2-[(2S)-2-oxidanyl-2-phenyl-ethanoyl]oxyethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(2-methylpropyl)-2-[2-[(2S)-2-oxidanyl-2-phenyl-ethanoyl]oxyethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[(2S)-2-hydroxy-2-phenyl-acetyl]oxyacetyl]amino]-4-isobutyl-thiophene-3-carboxylate CAS Name: 2-[[2-[(2S)-2-hydroxy-1-oxo-2-phenylethoxy]-1-oxoethyl]amino]-4-(2-methylpropyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(2S)-2-hydroxy-2-phenylacetyl]oxyacetyl]amino]-4-(2-methylpropyl)thiophene-3-carboxylate Traditional Name: 2-[[2-[(2S)-2-hydroxy-2-phenyl-acetyl]oxyacetyl]amino]-4-isobutyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H25NO6S MolecularWeight: 419.4913

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1CC(C)C)NC(=O)COC(=O)C(C2=CC=CC=C2)O

Isomeric SMILES

CCOC(=O)C1=C(SC=C1CC(C)C)NC(=O)COC(=O)[C@H](C2=CC=CC=C2)O

InChI

InChI=1S/C21H25NO6S/c1-4-27-20(25)17-15(10-13(2)3)12-29-19(17)22-16(23)11-28-21(26)18(24)14-8-6-5-7-9-14/h5-9,12-13,18,24H,4,10-11H2,1-3H3,(H,22,23)/t18-/m0/s1