ethyl 4-(3,4-dimethoxyphenyl)-2-(2-pyrrolidin-1-ylethanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-(3,4-dimethoxyphenyl)-2-(2-pyrrolidin-1-ylethanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-(3,4-dimethoxyphenyl)-2-[(2-pyrrolidin-1-ylacetyl)amino]thiophene-3-carboxylate CAS Name: 4-(3,4-dimethoxyphenyl)-2-[[1-oxo-2-(1-pyrrolidinyl)ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3,4-dimethoxyphenyl)-2-[(2-pyrrolidin-1-ylacetyl)amino]thiophene-3-carboxylate Traditional Name: 4-(3,4-dimethoxyphenyl)-2-[(2-pyrrolidinoacetyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)OC)OC)NC(=O)CN3CCCC3

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)OC)OC)NC(=O)CN3CCCC3

InChI

InChI=1S/C21H26N2O5S/c1-4-28-21(25)19-15(14-7-8-16(26-2)17(11-14)27-3)13-29-20(19)22-18(24)12-23-9-5-6-10-23/h7-8,11,13H,4-6,9-10,12H2,1-3H3,(H,22,24)