3-cyclohexyl-4-ethyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 3-cyclohexyl-4-ethyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-cyclohexyl-4-ethyl-5-(p-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-cyclohexyl-4-ethyl-5-[(4-methylphenyl)methylthio]-1,2,4-triazole IUPAC Name: 3-cyclohexyl-4-ethyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-cyclohexyl-4-ethyl-5-[(4-methylbenzyl)thio]-1,2,4-triazole Formula: C18H25N3S MolecularWeight: 315.4762

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=C(C=C2)C)C3CCCCC3

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=C(C=C2)C)C3CCCCC3

InChI

InChI=1S/C18H25N3S/c1-3-21-17(16-7-5-4-6-8-16)19-20-18(21)22-13-15-11-9-14(2)10-12-15/h9-12,16H,3-8,13H2,1-2H3