5-phenyl-9-[4-(phenylmethyl)piperazin-1-yl]-1,3-dihydro-1,4-benzodiazepin-2-one

Systemtic Name: 5-phenyl-9-[4-(phenylmethyl)piperazin-1-yl]-1,3-dihydro-1,4-benzodiazepin-2-one Openeye Name: 9-(4-benzylpiperazin-1-yl)-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one CAS Name: 5-phenyl-9-[4-(phenylmethyl)-1-piperazinyl]-1,3-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 9-(4-benzylpiperazin-1-yl)-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one Traditional Name: 9-(4-benzylpiperazino)-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one Formula: C26H26N4O MolecularWeight: 410.51084

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=CC=CC4=C3NC(=O)CN=C4C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=CC=CC4=C3NC(=O)CN=C4C5=CC=CC=C5

InChI

InChI=1S/C26H26N4O/c31-24-18-27-25(21-10-5-2-6-11-21)22-12-7-13-23(26(22)28-24)30-16-14-29(15-17-30)19-20-8-3-1-4-9-20/h1-13H,14-19H2,(H,28,31)