1-azanyl-3-[3-(2-fluoranylpyridin-3-yl)phenyl]-3-pyridin-4-yl-isoindole-5-carbonitrile

Systemtic Name: 1-azanyl-3-[3-(2-fluoranylpyridin-3-yl)phenyl]-3-pyridin-4-yl-isoindole-5-carbonitrile Openeye Name: 1-amino-3-[3-(2-fluoro-3-pyridyl)phenyl]-3-(4-pyridyl)isoindole-5-carbonitrile CAS Name: 1-amino-3-[3-(2-fluoro-3-pyridinyl)phenyl]-3-pyridin-4-yl-5-isoindolecarbonitrile IUPAC Name: 1-amino-3-[3-(2-fluoropyridin-3-yl)phenyl]-3-pyridin-4-ylisoindole-5-carbonitrile Traditional Name: 1-amino-3-[3-(2-fluoro-3-pyridyl)phenyl]-3-(4-pyridyl)isoindole-5-carbonitrile Formula: C25H16FN5 MolecularWeight: 405.426443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C2(C3=C(C=CC(=C3)C#N)C(=N2)N)C4=CC=NC=C4)C5=C(N=CC=C5)F

Isomeric SMILES

C1=CC(=CC(=C1)C2(C3=C(C=CC(=C3)C#N)C(=N2)N)C4=CC=NC=C4)C5=C(N=CC=C5)F

InChI

InChI=1S/C25H16FN5/c26-23-20(5-2-10-30-23)17-3-1-4-19(14-17)25(18-8-11-29-12-9-18)22-13-16(15-27)6-7-21(22)24(28)31-25/h1-14H,(H2,28,31)