N-[2-(cyanomethylsulfanyl)phenyl]-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-yl]ethanamide

Systemtic Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-yl]ethanamide Openeye Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-[(2R)-2-(2-thienyl)pyrrolidin-1-yl]acetamide CAS Name: N-[2-(cyanomethylthio)phenyl]-2-[(2R)-2-thiophen-2-yl-1-pyrrolidinyl]acetamide IUPAC Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-yl]acetamide Traditional Name: N-[2-(cyanomethylthio)phenyl]-2-[(2R)-2-(2-thienyl)pyrrolidino]acetamide Formula: C18H19N3OS2 MolecularWeight: 357.49296

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)CC(=O)NC2=CC=CC=C2SCC#N)C3=CC=CS3

Isomeric SMILES

C1C[C@@H](N(C1)CC(=O)NC2=CC=CC=C2SCC#N)C3=CC=CS3

InChI

InChI=1S/C18H19N3OS2/c19-9-12-24-16-7-2-1-5-14(16)20-18(22)13-21-10-3-6-15(21)17-8-4-11-23-17/h1-2,4-5,7-8,11,15H,3,6,10,12-13H2,(H,20,22)/t15-/m1/s1