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

Systemtic Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-cyclohexyl-4-(4-methoxyphenyl)-1,2,4-triazole Openeye Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-cyclohexyl-4-(4-methoxyphenyl)-1,2,4-triazole CAS Name: 3-[(4-chlorophenyl)methylthio]-5-cyclohexyl-4-(4-methoxyphenyl)-1,2,4-triazole IUPAC Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-cyclohexyl-4-(4-methoxyphenyl)-1,2,4-triazole Traditional Name: 3-[(4-chlorobenzyl)thio]-5-cyclohexyl-4-(4-methoxyphenyl)-1,2,4-triazole Formula: C22H24ClN3OS MolecularWeight: 413.96346

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)Cl)C4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)Cl)C4CCCCC4

InChI

InChI=1S/C22H24ClN3OS/c1-27-20-13-11-19(12-14-20)26-21(17-5-3-2-4-6-17)24-25-22(26)28-15-16-7-9-18(23)10-8-16/h7-14,17H,2-6,15H2,1H3