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

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-5-oxidanylidene-1-(thiophen-2-ylmethyl)pyrrolidine-2-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-5-oxo-1-(2-thienylmethyl)pyrrolidine-2-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-5-oxo-1-(thiophen-2-ylmethyl)-2-pyrrolidinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-5-oxo-1-(thiophen-2-ylmethyl)pyrrolidine-2-carboxamide Traditional Name: N-homoveratryl-5-keto-2-methyl-1-(2-thenyl)pyrrolidine-2-carboxamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(=O)N1CC2=CC=CS2)C(=O)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1(CCC(=O)N1CC2=CC=CS2)C(=O)NCCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H26N2O4S/c1-21(10-8-19(24)23(21)14-16-5-4-12-28-16)20(25)22-11-9-15-6-7-17(26-2)18(13-15)27-3/h4-7,12-13H,8-11,14H2,1-3H3,(H,22,25)