3-cyclohexyl-4-methyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole

Systemtic Name: 3-cyclohexyl-4-methyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole Openeye Name: 3-cyclohexyl-4-methyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole CAS Name: 3-cyclohexyl-4-methyl-5-(2-phenoxyethylthio)-1,2,4-triazole IUPAC Name: 3-cyclohexyl-4-methyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole Traditional Name: 3-cyclohexyl-4-methyl-5-(2-phenoxyethylthio)-1,2,4-triazole Formula: C17H23N3OS MolecularWeight: 317.44902

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCOC2=CC=CC=C2)C3CCCCC3

Isomeric SMILES

CN1C(=NN=C1SCCOC2=CC=CC=C2)C3CCCCC3

InChI

InChI=1S/C17H23N3OS/c1-20-16(14-8-4-2-5-9-14)18-19-17(20)22-13-12-21-15-10-6-3-7-11-15/h3,6-7,10-11,14H,2,4-5,8-9,12-13H2,1H3