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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=C2SCC3=CC=CC=C3Cl)COC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)N2C(=NN=C2SCC3=CC=CC=C3Cl)COC4=CC=CC=C4

InChI

InChI=1S/C22H24ClN3OS/c23-20-14-8-7-9-17(20)16-28-22-25-24-21(15-27-19-12-5-2-6-13-19)26(22)18-10-3-1-4-11-18/h2,5-9,12-14,18H,1,3-4,10-11,15-16H2