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

Systemtic Name: 3-(4-chlorophenyl)-4-methyl-5-(oxan-2-ylmethylsulfanyl)-1,2,4-triazole Openeye Name: 3-(4-chlorophenyl)-4-methyl-5-(tetrahydropyran-2-ylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-(4-chlorophenyl)-4-methyl-5-(2-oxanylmethylthio)-1,2,4-triazole IUPAC Name: 3-(4-chlorophenyl)-4-methyl-5-(oxan-2-ylmethylsulfanyl)-1,2,4-triazole Traditional Name: 3-(4-chlorophenyl)-4-methyl-5-(tetrahydropyran-2-ylmethylthio)-1,2,4-triazole Formula: C15H18ClN3OS MolecularWeight: 323.84092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18ClN3OS/c1-19-14(11-5-7-12(16)8-6-11)17-18-15(19)21-10-13-4-2-3-9-20-13/h5-8,13H,2-4,9-10H2,1H3