1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxidanylidene-N-[phenyl(thiophen-2-yl)methyl]pyrrolidine-3-carboxamide

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxidanylidene-N-[phenyl(thiophen-2-yl)methyl]pyrrolidine-3-carboxamide Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-N-[phenyl(2-thienyl)methyl]pyrrolidine-3-carboxamide CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-N-[phenyl(thiophen-2-yl)methyl]-3-pyrrolidinecarboxamide IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-N-[phenyl(thiophen-2-yl)methyl]pyrrolidine-3-carboxamide Traditional Name: 1-homoveratryl-5-keto-N-[phenyl(2-thienyl)methyl]pyrrolidine-3-carboxamide Formula: C26H28N2O4S MolecularWeight: 464.57652

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2CC(CC2=O)C(=O)NC(C3=CC=CC=C3)C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2CC(CC2=O)C(=O)NC(C3=CC=CC=C3)C4=CC=CS4)OC

InChI

InChI=1S/C26H28N2O4S/c1-31-21-11-10-18(15-22(21)32-2)12-13-28-17-20(16-24(28)29)26(30)27-25(23-9-6-14-33-23)19-7-4-3-5-8-19/h3-11,14-15,20,25H,12-13,16-17H2,1-2H3,(H,27,30)