N-[[4-methyl-5-(pyridin-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]pent-4-enamide

Systemtic Name: N-[[4-methyl-5-(pyridin-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]pent-4-enamide Openeye Name: N-[[4-methyl-5-(2-pyridylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]pent-4-enamide CAS Name: N-[[4-methyl-5-(2-pyridinylmethylthio)-1,2,4-triazol-3-yl]methyl]-4-pentenamide IUPAC Name: N-[[4-methyl-5-(pyridin-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]pent-4-enamide Traditional Name: N-[[4-methyl-5-(2-pyridylmethylthio)-1,2,4-triazol-3-yl]methyl]pent-4-enamide Formula: C15H19N5OS MolecularWeight: 317.40926

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=CC=N2)CNC(=O)CCC=C

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=CC=N2)CNC(=O)CCC=C

InChI

InChI=1S/C15H19N5OS/c1-3-4-8-14(21)17-10-13-18-19-15(20(13)2)22-11-12-7-5-6-9-16-12/h3,5-7,9H,1,4,8,10-11H2,2H3,(H,17,21)