2-[[4-(4-fluorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzoxazole

Systemtic Name: 2-[[4-(4-fluorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzoxazole Openeye Name: 2-[[4-(4-fluorophenyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzoxazole CAS Name: 2-[[[4-(4-fluorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]methyl]-1,3-benzoxazole IUPAC Name: 2-[[4-(4-fluorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzoxazole Traditional Name: 2-[[[4-(4-fluorophenyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]-1,3-benzoxazole Formula: C21H14FN5OS MolecularWeight: 403.432163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)CSC3=NN=C(N3C4=CC=C(C=C4)F)C5=CC=NC=C5

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)CSC3=NN=C(N3C4=CC=C(C=C4)F)C5=CC=NC=C5

InChI

InChI=1S/C21H14FN5OS/c22-15-5-7-16(8-6-15)27-20(14-9-11-23-12-10-14)25-26-21(27)29-13-19-24-17-3-1-2-4-18(17)28-19/h1-12H,13H2