dipropan-2-yl 3-methyl-5-(3-phenylpropanoylamino)thiophene-2,4-dicarboxylate

Systemtic Name: dipropan-2-yl 3-methyl-5-(3-phenylpropanoylamino)thiophene-2,4-dicarboxylate Openeye Name: diisopropyl 3-methyl-5-(3-phenylpropanoylamino)thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[(1-oxo-3-phenylpropyl)amino]thiophene-2,4-dicarboxylic acid dipropan-2-yl ester IUPAC Name: dipropan-2-yl 3-methyl-5-(3-phenylpropanoylamino)thiophene-2,4-dicarboxylate Traditional Name: 5-(hydrocinnamoylamino)-3-methyl-thiophene-2,4-dicarboxylic acid diisopropyl ester Formula: C22H27NO5S MolecularWeight: 417.51848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)CCC2=CC=CC=C2)C(=O)OC(C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)CCC2=CC=CC=C2)C(=O)OC(C)C

InChI

InChI=1S/C22H27NO5S/c1-13(2)27-21(25)18-15(5)19(22(26)28-14(3)4)29-20(18)23-17(24)12-11-16-9-7-6-8-10-16/h6-10,13-14H,11-12H2,1-5H3,(H,23,24)