ethanedioic acid; ethyl 2-[[2-[(4-methoxyphenyl)methylamino]-2-phenyl-ethanoyl]amino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethanedioic acid; ethyl 2-[[2-[(4-methoxyphenyl)methylamino]-2-phenyl-ethanoyl]amino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[(4-methoxyphenyl)methylamino]-2-phenyl-acetyl]amino]-4-phenyl-thiophene-3-carboxylate; oxalic acid CAS Name: 2-[[2-[(4-methoxyphenyl)methylamino]-1-oxo-2-phenylethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester; oxalic acid IUPAC Name: ethyl 2-[[2-[(4-methoxyphenyl)methylamino]-2-phenylacetyl]amino]-4-phenylthiophene-3-carboxylate; oxalic acid Traditional Name: oxalic acid; 2-[[2-(p-anisylamino)-2-phenyl-acetyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C31H30N2O8S MolecularWeight: 590.6435

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C(C3=CC=CC=C3)NCC4=CC=C(C=C4)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C(C3=CC=CC=C3)NCC4=CC=C(C=C4)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C29H28N2O4S.C2H2O4/c1-3-35-29(33)25-24(21-10-6-4-7-11-21)19-36-28(25)31-27(32)26(22-12-8-5-9-13-22)30-18-20-14-16-23(34-2)17-15-20;3-1(4)2(5)6/h4-17,19,26,30H,3,18H2,1-2H3,(H,31,32);(H,3,4)(H,5,6)