N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide

Systemtic Name: N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide Openeye Name: N-[3-(2-oxopyrrolidin-1-yl)phenyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide CAS Name: N-[3-(2-oxo-1-pyrrolidinyl)phenyl]-2-(1H-1,2,4-triazol-5-ylthio)acetamide IUPAC Name: N-[3-(2-oxopyrrolidin-1-yl)phenyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide Traditional Name: N-[3-(2-ketopyrrolidino)phenyl]-2-(1H-1,2,4-triazol-5-ylthio)acetamide Formula: C14H15N5O2S MolecularWeight: 317.3662

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC(=CC=C2)NC(=O)CSC3=NC=NN3

Isomeric SMILES

C1CC(=O)N(C1)C2=CC(=CC=C2)NC(=O)CSC3=NC=NN3

InChI

InChI=1S/C14H15N5O2S/c20-12(8-22-14-15-9-16-18-14)17-10-3-1-4-11(7-10)19-6-2-5-13(19)21/h1,3-4,7,9H,2,5-6,8H2,(H,17,20)(H,15,16,18)