1-(1H-imidazol-5-ylmethyl)-2-phenethyl-4,5-dihydro-2H-1,4-benzodiazepin-3-one

Systemtic Name: 1-(1H-imidazol-5-ylmethyl)-2-phenethyl-4,5-dihydro-2H-1,4-benzodiazepin-3-one Openeye Name: 1-(1H-imidazol-5-ylmethyl)-2-phenethyl-4,5-dihydro-2H-1,4-benzodiazepin-3-one CAS Name: 1-(1H-imidazol-5-ylmethyl)-2-phenethyl-4,5-dihydro-2H-1,4-benzodiazepin-3-one IUPAC Name: 1-(1H-imidazol-5-ylmethyl)-2-phenethyl-4,5-dihydro-2H-1,4-benzodiazepin-3-one Traditional Name: 1-(1H-imidazol-5-ylmethyl)-2-phenethyl-4,5-dihydro-2H-1,4-benzodiazepin-3-one Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2N(C(C(=O)N1)CCC3=CC=CC=C3)CC4=CN=CN4

Isomeric SMILES

C1C2=CC=CC=C2N(C(C(=O)N1)CCC3=CC=CC=C3)CC4=CN=CN4

InChI

InChI=1S/C21H22N4O/c26-21-20(11-10-16-6-2-1-3-7-16)25(14-18-13-22-15-24-18)19-9-5-4-8-17(19)12-23-21/h1-9,13,15,20H,10-12,14H2,(H,22,24)(H,23,26)