N-(1,3-benzodioxol-5-ylmethyl)-3-[5-oxidanylidene-2-(thiophen-2-ylmethyl)pyrrolidin-2-yl]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[5-oxidanylidene-2-(thiophen-2-ylmethyl)pyrrolidin-2-yl]propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[5-oxo-2-(2-thienylmethyl)pyrrolidin-2-yl]propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[5-oxo-2-(thiophen-2-ylmethyl)-2-pyrrolidinyl]propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[5-oxo-2-(thiophen-2-ylmethyl)pyrrolidin-2-yl]propanamide Traditional Name: 3-[5-keto-2-(2-thenyl)pyrrolidin-2-yl]-N-piperonyl-propionamide Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1=O)(CCC(=O)NCC2=CC3=C(C=C2)OCO3)CC4=CC=CS4

Isomeric SMILES

C1CC(NC1=O)(CCC(=O)NCC2=CC3=C(C=C2)OCO3)CC4=CC=CS4

InChI

InChI=1S/C20H22N2O4S/c23-18(21-12-14-3-4-16-17(10-14)26-13-25-16)5-7-20(8-6-19(24)22-20)11-15-2-1-9-27-15/h1-4,9-10H,5-8,11-13H2,(H,21,23)(H,22,24)