3-[(4-cyclohexylphenoxy)methyl]-5-(diphenylmethyl)sulfanyl-4-phenyl-1,2,4-triazole

Systemtic Name: 3-[(4-cyclohexylphenoxy)methyl]-5-(diphenylmethyl)sulfanyl-4-phenyl-1,2,4-triazole Openeye Name: 3-benzhydrylsulfanyl-5-[(4-cyclohexylphenoxy)methyl]-4-phenyl-1,2,4-triazole CAS Name: 3-[(4-cyclohexylphenoxy)methyl]-5-[(diphenylmethyl)thio]-4-phenyl-1,2,4-triazole IUPAC Name: 3-benzhydrylsulfanyl-5-[(4-cyclohexylphenoxy)methyl]-4-phenyl-1,2,4-triazole Traditional Name: 3-(benzhydrylthio)-5-[(4-cyclohexylphenoxy)methyl]-4-phenyl-1,2,4-triazole Formula: C34H33N3OS MolecularWeight: 531.71032

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)OCC3=NN=C(N3C4=CC=CC=C4)SC(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)OCC3=NN=C(N3C4=CC=CC=C4)SC(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C34H33N3OS/c1-5-13-26(14-6-1)27-21-23-31(24-22-27)38-25-32-35-36-34(37(32)30-19-11-4-12-20-30)39-33(28-15-7-2-8-16-28)29-17-9-3-10-18-29/h2-4,7-12,15-24,26,33H,1,5-6,13-14,25H2