1-[(4-pyridin-2-yl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]pyrrolidin-2-one

Systemtic Name: 1-[(4-pyridin-2-yl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]pyrrolidin-2-one Openeye Name: 1-[[4-(2-pyridyl)-5-thioxo-1H-1,2,4-triazol-3-yl]methyl]pyrrolidin-2-one CAS Name: 1-[[4-(2-pyridinyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]-2-pyrrolidinone IUPAC Name: 1-[(4-pyridin-2-yl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]pyrrolidin-2-one Traditional Name: 1-[[4-(2-pyridyl)-5-thioxo-1H-1,2,4-triazol-3-yl]methyl]-2-pyrrolidone Formula: C12H13N5OS MolecularWeight: 275.32952

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CC2=NNC(=S)N2C3=CC=CC=N3

Isomeric SMILES

C1CC(=O)N(C1)CC2=NNC(=S)N2C3=CC=CC=N3

InChI

InChI=1S/C12H13N5OS/c18-11-5-3-7-16(11)8-10-14-15-12(19)17(10)9-4-1-2-6-13-9/h1-2,4,6H,3,5,7-8H2,(H,15,19)