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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1=O)(CCC(=O)NCC2=CSC=C2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1C[C@](NC1=O)(CCC(=O)NCC2=CSC=C2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H22N2O4S/c23-18(21-11-15-5-8-27-12-15)3-6-20(7-4-19(24)22-20)10-14-1-2-16-17(9-14)26-13-25-16/h1-2,5,8-9,12H,3-4,6-7,10-11,13H2,(H,21,23)(H,22,24)/t20-/m1/s1