3-butyl-5-[1-[[5-(4-fluorophenyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl]-1,2,4-oxadiazole

Systemtic Name: 3-butyl-5-[1-[[5-(4-fluorophenyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl]-1,2,4-oxadiazole Openeye Name: 5-[1-[[4-benzyl-5-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl]-3-butyl-1,2,4-oxadiazole CAS Name: 3-butyl-5-[1-[[5-(4-fluorophenyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]ethyl]-1,2,4-oxadiazole IUPAC Name: 5-[1-[[4-benzyl-5-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl]-3-butyl-1,2,4-oxadiazole Traditional Name: 5-[1-[[4-benzyl-5-(4-fluorophenyl)-1,2,4-triazol-3-yl]thio]ethyl]-3-butyl-1,2,4-oxadiazole Formula: C23H24FN5OS MolecularWeight: 437.532963

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NOC(=N1)C(C)SC2=NN=C(N2CC3=CC=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

CCCCC1=NOC(=N1)C(C)SC2=NN=C(N2CC3=CC=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H24FN5OS/c1-3-4-10-20-25-22(30-28-20)16(2)31-23-27-26-21(18-11-13-19(24)14-12-18)29(23)15-17-8-6-5-7-9-17/h5-9,11-14,16H,3-4,10,15H2,1-2H3