ethanedioic acid; ethyl 2-[2-(diethylamino)ethanoylamino]-4-(4-methylphenyl)thiophene-3-carboxylate

Systemtic Name: ethanedioic acid; ethyl 2-[2-(diethylamino)ethanoylamino]-4-(4-methylphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(diethylamino)acetyl]amino]-4-(p-tolyl)thiophene-3-carboxylate; oxalic acid CAS Name: 2-[[2-(diethylamino)-1-oxoethyl]amino]-4-(4-methylphenyl)-3-thiophenecarboxylic acid ethyl ester; oxalic acid IUPAC Name: ethyl 2-[[2-(diethylamino)acetyl]amino]-4-(4-methylphenyl)thiophene-3-carboxylate; oxalic acid Traditional Name: 2-[[2-(diethylamino)acetyl]amino]-4-(p-tolyl)thiophene-3-carboxylic acid ethyl ester; oxalic acid Formula: C22H28N2O7S MolecularWeight: 464.53192

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)C)C(=O)OCC.C(=O)(C(=O)O)O

Isomeric SMILES

CCN(CC)CC(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)C)C(=O)OCC.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H26N2O3S.C2H2O4/c1-5-22(6-2)12-17(23)21-19-18(20(24)25-7-3)16(13-26-19)15-10-8-14(4)9-11-15;3-1(4)2(5)6/h8-11,13H,5-7,12H2,1-4H3,(H,21,23);(H,3,4)(H,5,6)