ethyl 5-ethyl-2-[2-[(2S)-2-phenoxybutanoyl]oxyethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-[2-[(2S)-2-phenoxybutanoyl]oxyethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[[2-[(2S)-2-phenoxybutanoyl]oxyacetyl]amino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[1-oxo-2-[(2S)-1-oxo-2-phenoxybutoxy]ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[[2-[(2S)-2-phenoxybutanoyl]oxyacetyl]amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[[2-[(2S)-2-phenoxybutanoyl]oxyacetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C21H25NO6S MolecularWeight: 419.4913

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)COC(=O)C(CC)OC2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)COC(=O)[C@H](CC)OC2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C21H25NO6S/c1-4-15-12-16(20(24)26-6-3)19(29-15)22-18(23)13-27-21(25)17(5-2)28-14-10-8-7-9-11-14/h7-12,17H,4-6,13H2,1-3H3,(H,22,23)/t17-/m0/s1