(2S)-N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-(2-thenoyl)pyrrolidine-2-carboxamide Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)NC(=O)C3CCCN3C(=O)C4=CC=CS4

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCO2)NC(=O)[C@@H]3CCCN3C(=O)C4=CC=CS4

InChI

InChI=1S/C19H20N2O4S/c1-12(13-6-7-15-16(10-13)25-11-24-15)20-18(22)14-4-2-8-21(14)19(23)17-5-3-9-26-17/h3,5-7,9-10,12,14H,2,4,8,11H2,1H3,(H,20,22)/t12?,14-/m0/s1