2-[[5-(6-ethylsulfonylpyridin-3-yl)oxy-2-pyrazin-2-yl-1H-pyrrolo[2,3-b]pyridin-6-yl]oxy]-3-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-[[5-(6-ethylsulfonylpyridin-3-yl)oxy-2-pyrazin-2-yl-1H-pyrrolo[2,3-b]pyridin-6-yl]oxy]-3-fluoranyl-benzenecarbonitrile Openeye Name: 2-[[5-[(6-ethylsulfonyl-3-pyridyl)oxy]-2-pyrazin-2-yl-1H-pyrrolo[2,3-b]pyridin-6-yl]oxy]-3-fluoro-benzonitrile CAS Name: 2-[[5-[(6-ethylsulfonyl-3-pyridinyl)oxy]-2-(2-pyrazinyl)-1H-pyrrolo[2,3-b]pyridin-6-yl]oxy]-3-fluorobenzonitrile IUPAC Name: 2-[[5-(6-ethylsulfonylpyridin-3-yl)oxy-2-pyrazin-2-yl-1H-pyrrolo[2,3-b]pyridin-6-yl]oxy]-3-fluorobenzonitrile Traditional Name: 2-[[5-[(6-esyl-3-pyridyl)oxy]-2-pyrazin-2-yl-1H-pyrrolo[2,3-b]pyridin-6-yl]oxy]-3-fluoro-benzonitrile Formula: C25H17FN6O4S MolecularWeight: 516.503683

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NC=C(C=C1)OC2=C(N=C3C(=C2)C=C(N3)C4=NC=CN=C4)OC5=C(C=CC=C5F)C#N

Isomeric SMILES

CCS(=O)(=O)C1=NC=C(C=C1)OC2=C(N=C3C(=C2)C=C(N3)C4=NC=CN=C4)OC5=C(C=CC=C5F)C#N

InChI

InChI=1S/C25H17FN6O4S/c1-2-37(33,34)22-7-6-17(13-30-22)35-21-11-16-10-19(20-14-28-8-9-29-20)31-24(16)32-25(21)36-23-15(12-27)4-3-5-18(23)26/h3-11,13-14H,2H2,1H3,(H,31,32)