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

Systemtic Name: 1-[(4-azanylquinazolin-7-yl)methyl]-4-(1H-benzimidazol-2-ylmethyl)piperazin-2-one Openeye Name: 1-[(4-aminoquinazolin-7-yl)methyl]-4-(1H-benzimidazol-2-ylmethyl)piperazin-2-one CAS Name: 1-[(4-amino-7-quinazolinyl)methyl]-4-(1H-benzimidazol-2-ylmethyl)-2-piperazinone IUPAC Name: 1-[(4-aminoquinazolin-7-yl)methyl]-4-(1H-benzimidazol-2-ylmethyl)piperazin-2-one Traditional Name: 1-[(4-aminoquinazolin-7-yl)methyl]-4-(1H-benzimidazol-2-ylmethyl)piperazin-2-one Formula: C21H21N7O MolecularWeight: 387.43774

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)CN1CC2=NC3=CC=CC=C3N2)CC4=CC5=C(C=C4)C(=NC=N5)N

Isomeric SMILES

C1CN(C(=O)CN1CC2=NC3=CC=CC=C3N2)CC4=CC5=C(C=C4)C(=NC=N5)N

InChI

InChI=1S/C21H21N7O/c22-21-15-6-5-14(9-18(15)23-13-24-21)10-28-8-7-27(12-20(28)29)11-19-25-16-3-1-2-4-17(16)26-19/h1-6,9,13H,7-8,10-12H2,(H,25,26)(H2,22,23,24)