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

Systemtic Name: 3-[(4-chlorophenyl)methylsulfanyl]-4-cyclohexyl-5-(phenylmethyl)-1,2,4-triazole Openeye Name: 3-benzyl-5-[(4-chlorophenyl)methylsulfanyl]-4-cyclohexyl-1,2,4-triazole CAS Name: 3-[(4-chlorophenyl)methylthio]-4-cyclohexyl-5-(phenylmethyl)-1,2,4-triazole IUPAC Name: 3-benzyl-5-[(4-chlorophenyl)methylsulfanyl]-4-cyclohexyl-1,2,4-triazole Traditional Name: 3-benzyl-5-[(4-chlorobenzyl)thio]-4-cyclohexyl-1,2,4-triazole Formula: C22H24ClN3S MolecularWeight: 397.96406

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=C2SCC3=CC=C(C=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)N2C(=NN=C2SCC3=CC=C(C=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C22H24ClN3S/c23-19-13-11-18(12-14-19)16-27-22-25-24-21(15-17-7-3-1-4-8-17)26(22)20-9-5-2-6-10-20/h1,3-4,7-8,11-14,20H,2,5-6,9-10,15-16H2