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

Systemtic Name: 1-[(4-azanylquinazolin-7-yl)methyl]-4-[(6-bromanyl-1H-benzimidazol-2-yl)methyl]piperazin-2-one Openeye Name: 1-[(4-aminoquinazolin-7-yl)methyl]-4-[(6-bromo-1H-benzimidazol-2-yl)methyl]piperazin-2-one CAS Name: 1-[(4-amino-7-quinazolinyl)methyl]-4-[(6-bromo-1H-benzimidazol-2-yl)methyl]-2-piperazinone IUPAC Name: 1-[(4-aminoquinazolin-7-yl)methyl]-4-[(6-bromo-1H-benzimidazol-2-yl)methyl]piperazin-2-one Traditional Name: 1-[(4-aminoquinazolin-7-yl)methyl]-4-[(6-bromo-1H-benzimidazol-2-yl)methyl]piperazin-2-one Formula: C21H20BrN7O MolecularWeight: 466.3338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20BrN7O/c22-14-2-4-16-18(8-14)27-19(26-16)10-28-5-6-29(20(30)11-28)9-13-1-3-15-17(7-13)24-12-25-21(15)23/h1-4,7-8,12H,5-6,9-11H2,(H,26,27)(H2,23,24,25)