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

Systemtic Name: (2S)-1-[2-(1,3-benzodioxol-5-yl)ethanoyl]-N-(thiophen-2-ylmethyl)pyrrolidine-2-carboxamide Openeye Name: (2S)-1-[2-(1,3-benzodioxol-5-yl)acetyl]-N-(2-thienylmethyl)pyrrolidine-2-carboxamide CAS Name: (2S)-1-[2-(1,3-benzodioxol-5-yl)-1-oxoethyl]-N-(thiophen-2-ylmethyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-[2-(1,3-benzodioxol-5-yl)acetyl]-N-(thiophen-2-ylmethyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-1-[2-(1,3-benzodioxol-5-yl)acetyl]-N-(2-thenyl)pyrrolidine-2-carboxamide Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CC2=CC3=C(C=C2)OCO3)C(=O)NCC4=CC=CS4

Isomeric SMILES

C1C[C@H](N(C1)C(=O)CC2=CC3=C(C=C2)OCO3)C(=O)NCC4=CC=CS4

InChI

InChI=1S/C19H20N2O4S/c22-18(10-13-5-6-16-17(9-13)25-12-24-16)21-7-1-4-15(21)19(23)20-11-14-3-2-8-26-14/h2-3,5-6,8-9,15H,1,4,7,10-12H2,(H,20,23)/t15-/m0/s1