5-[(5-cyclohexyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(diphenylmethyl)-1,2,4-oxadiazole

Systemtic Name: 5-[(5-cyclohexyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(diphenylmethyl)-1,2,4-oxadiazole Openeye Name: 3-benzhydryl-5-[(5-cyclohexyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2,4-oxadiazole CAS Name: 5-[[(5-cyclohexyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-3-(diphenylmethyl)-1,2,4-oxadiazole IUPAC Name: 3-benzhydryl-5-[(5-cyclohexyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2,4-oxadiazole Traditional Name: 3-benzhydryl-5-[[(5-cyclohexyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-1,2,4-oxadiazole Formula: C30H29N5OS MolecularWeight: 507.64916

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NN=C(N2C3=CC=CC=C3)SCC4=NC(=NO4)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CCC(CC1)C2=NN=C(N2C3=CC=CC=C3)SCC4=NC(=NO4)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C30H29N5OS/c1-5-13-22(14-6-1)27(23-15-7-2-8-16-23)28-31-26(36-34-28)21-37-30-33-32-29(24-17-9-3-10-18-24)35(30)25-19-11-4-12-20-25/h1-2,4-8,11-16,19-20,24,27H,3,9-10,17-18,21H2