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

Systemtic Name: 3-[6-[1-[3-(trifluoromethyloxy)phenyl]ethylamino]pyrazin-2-yl]benzimidazole-5-carbonitrile Openeye Name: 3-[6-[1-[3-(trifluoromethoxy)phenyl]ethylamino]pyrazin-2-yl]benzimidazole-5-carbonitrile CAS Name: 3-[6-[1-[3-(trifluoromethoxy)phenyl]ethylamino]-2-pyrazinyl]-5-benzimidazolecarbonitrile IUPAC Name: 3-[6-[1-[3-(trifluoromethoxy)phenyl]ethylamino]pyrazin-2-yl]benzimidazole-5-carbonitrile Traditional Name: 3-[6-[1-[3-(trifluoromethoxy)phenyl]ethylamino]pyrazin-2-yl]benzimidazole-5-carbonitrile Formula: C21H15F3N6O MolecularWeight: 424.37861

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H15F3N6O/c1-13(15-3-2-4-16(8-15)31-21(22,23)24)28-19-10-26-11-20(29-19)30-12-27-17-6-5-14(9-25)7-18(17)30/h2-8,10-13H,1H3,(H,28,29)