7-[4-azanyl-4-(1H-benzimidazol-2-ylmethyl)-5,5,5-tris(fluoranyl)-2-methyl-pentan-2-yl]-2,3-dihydro-1-benzofuran-5-carbonitrile

Systemtic Name: 7-[4-azanyl-4-(1H-benzimidazol-2-ylmethyl)-5,5,5-tris(fluoranyl)-2-methyl-pentan-2-yl]-2,3-dihydro-1-benzofuran-5-carbonitrile Openeye Name: 7-[3-amino-3-(1H-benzimidazol-2-ylmethyl)-4,4,4-trifluoro-1,1-dimethyl-butyl]-2,3-dihydrobenzofuran-5-carbonitrile CAS Name: 7-[4-amino-4-(1H-benzimidazol-2-ylmethyl)-5,5,5-trifluoro-2-methylpentan-2-yl]-2,3-dihydrobenzofuran-5-carbonitrile IUPAC Name: 7-[4-amino-4-(1H-benzimidazol-2-ylmethyl)-5,5,5-trifluoro-2-methylpentan-2-yl]-2,3-dihydro-1-benzofuran-5-carbonitrile Traditional Name: 7-[3-amino-3-(1H-benzimidazol-2-ylmethyl)-4,4,4-trifluoro-1,1-dimethyl-butyl]coumaran-5-carbonitrile Formula: C23H23F3N4O MolecularWeight: 428.45013

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(CC1=NC2=CC=CC=C2N1)(C(F)(F)F)N)C3=CC(=CC4=C3OCC4)C#N

Isomeric SMILES

CC(C)(CC(CC1=NC2=CC=CC=C2N1)(C(F)(F)F)N)C3=CC(=CC4=C3OCC4)C#N

InChI

InChI=1S/C23H23F3N4O/c1-21(2,16-10-14(12-27)9-15-7-8-31-20(15)16)13-22(28,23(24,25)26)11-19-29-17-5-3-4-6-18(17)30-19/h3-6,9-10H,7-8,11,13,28H2,1-2H3,(H,29,30)