1-butyl-2-(4-methoxyphenyl)-5-oxidanylidene-N-(1-thiophen-2-ylethyl)pyrrolidine-3-carboxamide

Systemtic Name: 1-butyl-2-(4-methoxyphenyl)-5-oxidanylidene-N-(1-thiophen-2-ylethyl)pyrrolidine-3-carboxamide Openeye Name: 1-butyl-2-(4-methoxyphenyl)-5-oxo-N-[1-(2-thienyl)ethyl]pyrrolidine-3-carboxamide CAS Name: 1-butyl-2-(4-methoxyphenyl)-5-oxo-N-(1-thiophen-2-ylethyl)-3-pyrrolidinecarboxamide IUPAC Name: 1-butyl-2-(4-methoxyphenyl)-5-oxo-N-(1-thiophen-2-ylethyl)pyrrolidine-3-carboxamide Traditional Name: 1-butyl-5-keto-2-(4-methoxyphenyl)-N-[1-(2-thienyl)ethyl]pyrrolidine-3-carboxamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C(CC1=O)C(=O)NC(C)C2=CC=CS2)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCCN1C(C(CC1=O)C(=O)NC(C)C2=CC=CS2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H28N2O3S/c1-4-5-12-24-20(25)14-18(21(24)16-8-10-17(27-3)11-9-16)22(26)23-15(2)19-7-6-13-28-19/h6-11,13,15,18,21H,4-5,12,14H2,1-3H3,(H,23,26)