1-(4-fluoranylphenoxy)-3-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propan-2-ol

Systemtic Name: 1-(4-fluoranylphenoxy)-3-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propan-2-ol Openeye Name: 1-(4-fluorophenoxy)-3-[[4-phenyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]propan-2-ol CAS Name: 1-(4-fluorophenoxy)-3-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-2-propanol IUPAC Name: 1-(4-fluorophenoxy)-3-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propan-2-ol Traditional Name: 1-(4-fluorophenoxy)-3-[[4-phenyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]propan-2-ol Formula: C22H19FN4O2S MolecularWeight: 422.475263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SCC(COC3=CC=C(C=C3)F)O)C4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SCC(COC3=CC=C(C=C3)F)O)C4=CC=NC=C4

InChI

InChI=1S/C22H19FN4O2S/c23-17-6-8-20(9-7-17)29-14-19(28)15-30-22-26-25-21(16-10-12-24-13-11-16)27(22)18-4-2-1-3-5-18/h1-13,19,28H,14-15H2