ethyl 2-[2-(3-phenylpropanoyloxy)ethanoylamino]-5-propan-2-yl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(3-phenylpropanoyloxy)ethanoylamino]-5-propan-2-yl-thiophene-3-carboxylate Openeye Name: ethyl 5-isopropyl-2-[[2-(3-phenylpropanoyloxy)acetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[1-oxo-2-(1-oxo-3-phenylpropoxy)ethyl]amino]-5-propan-2-yl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(3-phenylpropanoyloxy)acetyl]amino]-5-propan-2-ylthiophene-3-carboxylate Traditional Name: 2-[(2-hydrocinnamoyloxyacetyl)amino]-5-isopropyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C(C)C)NC(=O)COC(=O)CCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C(C)C)NC(=O)COC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C21H25NO5S/c1-4-26-21(25)16-12-17(14(2)3)28-20(16)22-18(23)13-27-19(24)11-10-15-8-6-5-7-9-15/h5-9,12,14H,4,10-11,13H2,1-3H3,(H,22,23)