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

Systemtic Name: methyl 1-(3,4-dimethoxyphenyl)carbonyl-5-piperazin-1-ylcarbonyl-2-thiophen-2-yl-pyrrolidine-3-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C24H29N3O6S MolecularWeight: 487.56856

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2C(CC(C2C3=CC=CS3)C(=O)OC)C(=O)N4CCNCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2C(CC(C2C3=CC=CS3)C(=O)OC)C(=O)N4CCNCC4)OC

InChI

InChI=1S/C24H29N3O6S/c1-31-18-7-6-15(13-19(18)32-2)22(28)27-17(23(29)26-10-8-25-9-11-26)14-16(24(30)33-3)21(27)20-5-4-12-34-20/h4-7,12-13,16-17,21,25H,8-11,14H2,1-3H3