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

Systemtic Name: 5-(5-chloranyl-2-methoxy-phenyl)-3-[[(2R)-oxan-2-yl]methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-(5-chloro-2-methoxy-phenyl)-3-[[(2R)-tetrahydropyran-2-yl]methylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-(5-chloro-2-methoxyphenyl)-3-[[(2R)-2-oxanyl]methylthio]-1H-1,2,4-triazole IUPAC Name: 5-(5-chloro-2-methoxyphenyl)-3-[[(2R)-oxan-2-yl]methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-(5-chloro-2-methoxy-phenyl)-3-[[(2R)-tetrahydropyran-2-yl]methylthio]-1H-1,2,4-triazole Formula: C15H18ClN3O2S MolecularWeight: 339.84032

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C2=NC(=NN2)SCC3CCCCO3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C2=NC(=NN2)SC[C@H]3CCCCO3

InChI

InChI=1S/C15H18ClN3O2S/c1-20-13-6-5-10(16)8-12(13)14-17-15(19-18-14)22-9-11-4-2-3-7-21-11/h5-6,8,11H,2-4,7,9H2,1H3,(H,17,18,19)/t11-/m1/s1