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

Systemtic Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-cyclohexyl-4-ethyl-1,2,4-triazole Openeye Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-cyclohexyl-4-ethyl-1,2,4-triazole CAS Name: 3-[(4-chlorophenyl)methylthio]-5-cyclohexyl-4-ethyl-1,2,4-triazole IUPAC Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-cyclohexyl-4-ethyl-1,2,4-triazole Traditional Name: 3-[(4-chlorobenzyl)thio]-5-cyclohexyl-4-ethyl-1,2,4-triazole Formula: C17H22ClN3S MolecularWeight: 335.89468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22ClN3S/c1-2-21-16(14-6-4-3-5-7-14)19-20-17(21)22-12-13-8-10-15(18)11-9-13/h8-11,14H,2-7,12H2,1H3