ethyl 4-(4-methylphenyl)-2-[2-(3-phenylpropanoyloxy)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-methylphenyl)-2-[2-(3-phenylpropanoyloxy)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(3-phenylpropanoyloxy)acetyl]amino]-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 4-(4-methylphenyl)-2-[[1-oxo-2-(1-oxo-3-phenylpropoxy)ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-methylphenyl)-2-[[2-(3-phenylpropanoyloxy)acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[(2-hydrocinnamoyloxyacetyl)amino]-4-(p-tolyl)thiophene-3-carboxylic acid ethyl ester Formula: C25H25NO5S MolecularWeight: 451.5347

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC(=O)COC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC(=O)COC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C25H25NO5S/c1-3-30-25(29)23-20(19-12-9-17(2)10-13-19)16-32-24(23)26-21(27)15-31-22(28)14-11-18-7-5-4-6-8-18/h4-10,12-13,16H,3,11,14-15H2,1-2H3,(H,26,27)