diethyl 3-methyl-5-(2-phenylbutanoylamino)thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-(2-phenylbutanoylamino)thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-(2-phenylbutanoylamino)thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[(1-oxo-2-phenylbutyl)amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-(2-phenylbutanoylamino)thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-(2-phenylbutanoylamino)thiophene-2,4-dicarboxylic acid diethyl ester Formula: C21H25NO5S MolecularWeight: 403.4919

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25NO5S/c1-5-15(14-11-9-8-10-12-14)18(23)22-19-16(20(24)26-6-2)13(4)17(28-19)21(25)27-7-3/h8-12,15H,5-7H2,1-4H3,(H,22,23)