ethyl 1-(3,4-dimethoxyphenyl)carbonyl-5-piperazin-1-ylcarbonyl-2-thiophen-2-yl-pyrrolidine-3-carboxylate

Systemtic Name: ethyl 1-(3,4-dimethoxyphenyl)carbonyl-5-piperazin-1-ylcarbonyl-2-thiophen-2-yl-pyrrolidine-3-carboxylate Openeye Name: ethyl 1-(3,4-dimethoxybenzoyl)-5-(piperazine-1-carbonyl)-2-(2-thienyl)pyrrolidine-3-carboxylate CAS Name: 1-[(3,4-dimethoxyphenyl)-oxomethyl]-5-[oxo(1-piperazinyl)methyl]-2-thiophen-2-yl-3-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3,4-dimethoxybenzoyl)-5-(piperazine-1-carbonyl)-2-thiophen-2-ylpyrrolidine-3-carboxylate Traditional Name: 5-(piperazine-1-carbonyl)-2-(2-thienyl)-1-veratroyl-pyrrolidine-3-carboxylic acid ethyl ester Formula: C25H31N3O6S MolecularWeight: 501.59514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(N(C1C2=CC=CS2)C(=O)C3=CC(=C(C=C3)OC)OC)C(=O)N4CCNCC4

Isomeric SMILES

CCOC(=O)C1CC(N(C1C2=CC=CS2)C(=O)C3=CC(=C(C=C3)OC)OC)C(=O)N4CCNCC4

InChI

InChI=1S/C25H31N3O6S/c1-4-34-25(31)17-15-18(24(30)27-11-9-26-10-12-27)28(22(17)21-6-5-13-35-21)23(29)16-7-8-19(32-2)20(14-16)33-3/h5-8,13-14,17-18,22,26H,4,9-12,15H2,1-3H3