1-[[3-[(2-fluorophenyl)methyl]-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]sulfanyl]propan-2-one

Systemtic Name: 1-[[3-[(2-fluorophenyl)methyl]-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]sulfanyl]propan-2-one Openeye Name: 1-[3-[(2-fluorophenyl)methyl]triazolo[4,5-d]pyrimidin-7-yl]sulfanylpropan-2-one CAS Name: 1-[[3-[(2-fluorophenyl)methyl]-7-triazolo[4,5-d]pyrimidinyl]thio]-2-propanone IUPAC Name: 1-[3-[(2-fluorophenyl)methyl]triazolo[4,5-d]pyrimidin-7-yl]sulfanylpropan-2-one Traditional Name: 1-[[3-(2-fluorobenzyl)triazolo[4,5-d]pyrimidin-7-yl]thio]acetone Formula: C14H12FN5OS MolecularWeight: 317.341383

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=NC=NC2=C1N=NN2CC3=CC=CC=C3F

Isomeric SMILES

CC(=O)CSC1=NC=NC2=C1N=NN2CC3=CC=CC=C3F

InChI

InChI=1S/C14H12FN5OS/c1-9(21)7-22-14-12-13(16-8-17-14)20(19-18-12)6-10-4-2-3-5-11(10)15/h2-5,8H,6-7H2,1H3