ethyl 2-[2-[(2R)-2-phenylbutanoyl]oxyethanoylamino]-5-propan-2-yl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[(2R)-2-phenylbutanoyl]oxyethanoylamino]-5-propan-2-yl-thiophene-3-carboxylate Openeye Name: ethyl 5-isopropyl-2-[[2-[(2R)-2-phenylbutanoyl]oxyacetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[1-oxo-2-[(2R)-1-oxo-2-phenylbutoxy]ethyl]amino]-5-propan-2-yl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(2R)-2-phenylbutanoyl]oxyacetyl]amino]-5-propan-2-ylthiophene-3-carboxylate Traditional Name: 5-isopropyl-2-[[2-[(2R)-2-phenylbutanoyl]oxyacetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C22H27NO5S MolecularWeight: 417.51848

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)OCC(=O)NC2=C(C=C(S2)C(C)C)C(=O)OCC

Isomeric SMILES

CC[C@H](C1=CC=CC=C1)C(=O)OCC(=O)NC2=C(C=C(S2)C(C)C)C(=O)OCC

InChI

InChI=1S/C22H27NO5S/c1-5-16(15-10-8-7-9-11-15)21(25)28-13-19(24)23-20-17(22(26)27-6-2)12-18(29-20)14(3)4/h7-12,14,16H,5-6,13H2,1-4H3,(H,23,24)/t16-/m1/s1