4-methyl-3-(oxan-2-ylmethylsulfanyl)-5-phenyl-1,2,4-triazole

Systemtic Name: 4-methyl-3-(oxan-2-ylmethylsulfanyl)-5-phenyl-1,2,4-triazole Openeye Name: 4-methyl-3-phenyl-5-(tetrahydropyran-2-ylmethylsulfanyl)-1,2,4-triazole CAS Name: 4-methyl-3-(2-oxanylmethylthio)-5-phenyl-1,2,4-triazole IUPAC Name: 4-methyl-3-(oxan-2-ylmethylsulfanyl)-5-phenyl-1,2,4-triazole Traditional Name: 4-methyl-3-phenyl-5-(tetrahydropyran-2-ylmethylthio)-1,2,4-triazole Formula: C15H19N3OS MolecularWeight: 289.39586

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2CCCCO2)C3=CC=CC=C3

Isomeric SMILES

CN1C(=NN=C1SCC2CCCCO2)C3=CC=CC=C3

InChI

InChI=1S/C15H19N3OS/c1-18-14(12-7-3-2-4-8-12)16-17-15(18)20-11-13-9-5-6-10-19-13/h2-4,7-8,13H,5-6,9-11H2,1H3