3-[6-[1-(4-fluoranyl-3-oxidanyl-phenyl)ethylamino]pyrazin-2-yl]benzimidazole-5-carbonitrile

Systemtic Name: 3-[6-[1-(4-fluoranyl-3-oxidanyl-phenyl)ethylamino]pyrazin-2-yl]benzimidazole-5-carbonitrile Openeye Name: 3-[6-[1-(4-fluoro-3-hydroxy-phenyl)ethylamino]pyrazin-2-yl]benzimidazole-5-carbonitrile CAS Name: 3-[6-[1-(4-fluoro-3-hydroxyphenyl)ethylamino]-2-pyrazinyl]-5-benzimidazolecarbonitrile IUPAC Name: 3-[6-[1-(4-fluoro-3-hydroxyphenyl)ethylamino]pyrazin-2-yl]benzimidazole-5-carbonitrile Traditional Name: 3-[6-[1-(4-fluoro-3-hydroxy-phenyl)ethylamino]pyrazin-2-yl]benzimidazole-5-carbonitrile Formula: C20H15FN6O MolecularWeight: 374.371103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)F)O)NC2=NC(=CN=C2)N3C=NC4=C3C=C(C=C4)C#N

Isomeric SMILES

CC(C1=CC(=C(C=C1)F)O)NC2=NC(=CN=C2)N3C=NC4=C3C=C(C=C4)C#N

InChI

InChI=1S/C20H15FN6O/c1-12(14-3-4-15(21)18(28)7-14)25-19-9-23-10-20(26-19)27-11-24-16-5-2-13(8-22)6-17(16)27/h2-7,9-12,28H,1H3,(H,25,26)