[1-(1H-imidazol-5-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-(2-phenylquinolin-4-yl)methanone

Systemtic Name: [1-(1H-imidazol-5-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-(2-phenylquinolin-4-yl)methanone Openeye Name: [1-(1H-imidazol-5-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-(2-phenyl-4-quinolyl)methanone CAS Name: [1-(1H-imidazol-5-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-(2-phenyl-4-quinolinyl)methanone IUPAC Name: [1-(1H-imidazol-5-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-(2-phenylquinolin-4-yl)methanone Traditional Name: [1-(1H-imidazol-5-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-(2-phenyl-4-quinolyl)methanone Formula: C29H25N5O MolecularWeight: 459.5417

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2CN1C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5)CC6=CN=CN6

Isomeric SMILES

C1CN(C2=CC=CC=C2CN1C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5)CC6=CN=CN6

InChI

InChI=1S/C29H25N5O/c35-29(25-16-27(21-8-2-1-3-9-21)32-26-12-6-5-11-24(25)26)34-15-14-33(19-23-17-30-20-31-23)28-13-7-4-10-22(28)18-34/h1-13,16-17,20H,14-15,18-19H2,(H,30,31)