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

Systemtic Name: 1-[(4-azanylquinazolin-7-yl)methyl]-4-[(6-chloranyl-1-methyl-benzimidazol-2-yl)methyl]piperazin-2-one Openeye Name: 1-[(4-aminoquinazolin-7-yl)methyl]-4-[(6-chloro-1-methyl-benzimidazol-2-yl)methyl]piperazin-2-one CAS Name: 1-[(4-amino-7-quinazolinyl)methyl]-4-[(6-chloro-1-methyl-2-benzimidazolyl)methyl]-2-piperazinone IUPAC Name: 1-[(4-aminoquinazolin-7-yl)methyl]-4-[(6-chloro-1-methylbenzimidazol-2-yl)methyl]piperazin-2-one Traditional Name: 1-[(4-aminoquinazolin-7-yl)methyl]-4-[(6-chloro-1-methyl-benzimidazol-2-yl)methyl]piperazin-2-one Formula: C22H22ClN7O MolecularWeight: 435.90938

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)Cl)N=C1CN3CCN(C(=O)C3)CC4=CC5=C(C=C4)C(=NC=N5)N

Isomeric SMILES

CN1C2=C(C=CC(=C2)Cl)N=C1CN3CCN(C(=O)C3)CC4=CC5=C(C=C4)C(=NC=N5)N

InChI

InChI=1S/C22H22ClN7O/c1-28-19-9-15(23)3-5-17(19)27-20(28)11-29-6-7-30(21(31)12-29)10-14-2-4-16-18(8-14)25-13-26-22(16)24/h2-5,8-9,13H,6-7,10-12H2,1H3,(H2,24,25,26)