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

Systemtic Name: 3-(4-chlorophenyl)-4-ethyl-5-[[(2R)-oxan-2-yl]methylsulfanyl]-1,2,4-triazole Openeye Name: 3-(4-chlorophenyl)-4-ethyl-5-[[(2R)-tetrahydropyran-2-yl]methylsulfanyl]-1,2,4-triazole CAS Name: 3-(4-chlorophenyl)-4-ethyl-5-[[(2R)-2-oxanyl]methylthio]-1,2,4-triazole IUPAC Name: 3-(4-chlorophenyl)-4-ethyl-5-[[(2R)-oxan-2-yl]methylsulfanyl]-1,2,4-triazole Traditional Name: 3-(4-chlorophenyl)-4-ethyl-5-[[(2R)-tetrahydropyran-2-yl]methylthio]-1,2,4-triazole Formula: C16H20ClN3OS MolecularWeight: 337.8675

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2CCCCO2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCN1C(=NN=C1SC[C@H]2CCCCO2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H20ClN3OS/c1-2-20-15(12-6-8-13(17)9-7-12)18-19-16(20)22-11-14-5-3-4-10-21-14/h6-9,14H,2-5,10-11H2,1H3/t14-/m1/s1