5-(4-methylphenyl)-3-[[(2R)-oxan-2-yl]methylsulfanyl]-1H-1,2,4-triazole

Systemtic Name: 5-(4-methylphenyl)-3-[[(2R)-oxan-2-yl]methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-(p-tolyl)-3-[[(2R)-tetrahydropyran-2-yl]methylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-(4-methylphenyl)-3-[[(2R)-2-oxanyl]methylthio]-1H-1,2,4-triazole IUPAC Name: 5-(4-methylphenyl)-3-[[(2R)-oxan-2-yl]methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-(p-tolyl)-3-[[(2R)-tetrahydropyran-2-yl]methylthio]-1H-1,2,4-triazole Formula: C15H19N3OS MolecularWeight: 289.39586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NN2)SCC3CCCCO3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NN2)SC[C@H]3CCCCO3

InChI

InChI=1S/C15H19N3OS/c1-11-5-7-12(8-6-11)14-16-15(18-17-14)20-10-13-4-2-3-9-19-13/h5-8,13H,2-4,9-10H2,1H3,(H,16,17,18)/t13-/m1/s1