1-[(4-azanylquinazolin-7-yl)methyl]-4-[[6-(trifluoromethyl)-1H-benzimidazol-2-yl]methyl]piperazin-2-one

Systemtic Name: 1-[(4-azanylquinazolin-7-yl)methyl]-4-[[6-(trifluoromethyl)-1H-benzimidazol-2-yl]methyl]piperazin-2-one Openeye Name: 1-[(4-aminoquinazolin-7-yl)methyl]-4-[[6-(trifluoromethyl)-1H-benzimidazol-2-yl]methyl]piperazin-2-one CAS Name: 1-[(4-amino-7-quinazolinyl)methyl]-4-[[6-(trifluoromethyl)-1H-benzimidazol-2-yl]methyl]-2-piperazinone IUPAC Name: 1-[(4-aminoquinazolin-7-yl)methyl]-4-[[6-(trifluoromethyl)-1H-benzimidazol-2-yl]methyl]piperazin-2-one Traditional Name: 1-[(4-aminoquinazolin-7-yl)methyl]-4-[[6-(trifluoromethyl)-1H-benzimidazol-2-yl]methyl]piperazin-2-one Formula: C22H20F3N7O MolecularWeight: 455.43571

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)CN1CC2=NC3=C(N2)C=C(C=C3)C(F)(F)F)CC4=CC5=C(C=C4)C(=NC=N5)N

Isomeric SMILES

C1CN(C(=O)CN1CC2=NC3=C(N2)C=C(C=C3)C(F)(F)F)CC4=CC5=C(C=C4)C(=NC=N5)N

InChI

InChI=1S/C22H20F3N7O/c23-22(24,25)14-2-4-16-18(8-14)30-19(29-16)10-31-5-6-32(20(33)11-31)9-13-1-3-15-17(7-13)27-12-28-21(15)26/h1-4,7-8,12H,5-6,9-11H2,(H,29,30)(H2,26,27,28)