ethanedioic acid; ethyl 4,5-dimethyl-2-(2-pyrrolidin-1-ylethanoylamino)thiophene-3-carboxylate

Systemtic Name: ethanedioic acid; ethyl 4,5-dimethyl-2-(2-pyrrolidin-1-ylethanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 4,5-dimethyl-2-[(2-pyrrolidin-1-ylacetyl)amino]thiophene-3-carboxylate; oxalic acid CAS Name: 4,5-dimethyl-2-[[1-oxo-2-(1-pyrrolidinyl)ethyl]amino]-3-thiophenecarboxylic acid ethyl ester; oxalic acid IUPAC Name: ethyl 4,5-dimethyl-2-[(2-pyrrolidin-1-ylacetyl)amino]thiophene-3-carboxylate; oxalic acid Traditional Name: 4,5-dimethyl-2-[(2-pyrrolidinoacetyl)amino]thiophene-3-carboxylic acid ethyl ester; oxalic acid Formula: C17H24N2O7S MolecularWeight: 400.44666

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CN2CCCC2.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CN2CCCC2.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H22N2O3S.C2H2O4/c1-4-20-15(19)13-10(2)11(3)21-14(13)16-12(18)9-17-7-5-6-8-17;3-1(4)2(5)6/h4-9H2,1-3H3,(H,16,18);(H,3,4)(H,5,6)