2-ethyl-5-[1-(2-fluoranylpyridin-3-yl)-5-methyl-1,2,3-triazol-4-yl]-3H-isoindol-1-one

Systemtic Name: 2-ethyl-5-[1-(2-fluoranylpyridin-3-yl)-5-methyl-1,2,3-triazol-4-yl]-3H-isoindol-1-one Openeye Name: 2-ethyl-5-[1-(2-fluoro-3-pyridyl)-5-methyl-triazol-4-yl]isoindolin-1-one CAS Name: 2-ethyl-5-[1-(2-fluoro-3-pyridinyl)-5-methyl-4-triazolyl]-3H-isoindol-1-one IUPAC Name: 2-ethyl-5-[1-(2-fluoropyridin-3-yl)-5-methyltriazol-4-yl]-3H-isoindol-1-one Traditional Name: 2-ethyl-5-[1-(2-fluoro-3-pyridyl)-5-methyl-triazol-4-yl]isoindolin-1-one Formula: C18H16FN5O MolecularWeight: 337.350943

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC2=C(C1=O)C=CC(=C2)C3=C(N(N=N3)C4=C(N=CC=C4)F)C

Isomeric SMILES

CCN1CC2=C(C1=O)C=CC(=C2)C3=C(N(N=N3)C4=C(N=CC=C4)F)C

InChI

InChI=1S/C18H16FN5O/c1-3-23-10-13-9-12(6-7-14(13)18(23)25)16-11(2)24(22-21-16)15-5-4-8-20-17(15)19/h4-9H,3,10H2,1-2H3