ethanedioic acid; ethyl 4-(4-fluorophenyl)-2-(3-morpholin-4-ylpropanoylamino)thiophene-3-carboxylate

Systemtic Name: ethanedioic acid; ethyl 4-(4-fluorophenyl)-2-(3-morpholin-4-ylpropanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-(4-fluorophenyl)-2-(3-morpholinopropanoylamino)thiophene-3-carboxylate; oxalic acid CAS Name: 4-(4-fluorophenyl)-2-[[3-(4-morpholinyl)-1-oxopropyl]amino]-3-thiophenecarboxylic acid ethyl ester; oxalic acid IUPAC Name: ethyl 4-(4-fluorophenyl)-2-(3-morpholin-4-ylpropanoylamino)thiophene-3-carboxylate; oxalic acid Traditional Name: 4-(4-fluorophenyl)-2-(3-morpholinopropanoylamino)thiophene-3-carboxylic acid ethyl ester; oxalic acid Formula: C22H25FN2O8S MolecularWeight: 496.505903

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)F)NC(=O)CCN3CCOCC3.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)F)NC(=O)CCN3CCOCC3.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H23FN2O4S.C2H2O4/c1-2-27-20(25)18-16(14-3-5-15(21)6-4-14)13-28-19(18)22-17(24)7-8-23-9-11-26-12-10-23;3-1(4)2(5)6/h3-6,13H,2,7-12H2,1H3,(H,22,24);(H,3,4)(H,5,6)