1-[4-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoyl]phenyl]pyrrolidin-2-one

Systemtic Name: 1-[4-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoyl]phenyl]pyrrolidin-2-one Openeye Name: 1-[4-[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]phenyl]pyrrolidin-2-one CAS Name: 1-[4-[1-oxo-2-(1H-1,2,4-triazol-5-ylthio)ethyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[4-[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]phenyl]pyrrolidin-2-one Traditional Name: 1-[4-[2-(1H-1,2,4-triazol-5-ylthio)acetyl]phenyl]-2-pyrrolidone Formula: C14H14N4O2S MolecularWeight: 302.35156

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14N4O2S/c19-12(8-21-14-15-9-16-17-14)10-3-5-11(6-4-10)18-7-1-2-13(18)20/h3-6,9H,1-2,7-8H2,(H,15,16,17)