8-(2-fluorophenyl)-4-(3-pyrimidin-5-ylphenyl)-1,3-dihydro-1,5-benzodiazepin-2-one

Systemtic Name: 8-(2-fluorophenyl)-4-(3-pyrimidin-5-ylphenyl)-1,3-dihydro-1,5-benzodiazepin-2-one Openeye Name: 8-(2-fluorophenyl)-4-(3-pyrimidin-5-ylphenyl)-1,3-dihydro-1,5-benzodiazepin-2-one CAS Name: 8-(2-fluorophenyl)-4-[3-(5-pyrimidinyl)phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one IUPAC Name: 8-(2-fluorophenyl)-4-(3-pyrimidin-5-ylphenyl)-1,3-dihydro-1,5-benzodiazepin-2-one Traditional Name: 8-(2-fluorophenyl)-4-[3-(5-pyrimidyl)phenyl]-1,3-dihydro-1,5-benzodiazepin-2-one Formula: C25H17FN4O MolecularWeight: 408.427083

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC2=C(C=C(C=C2)C3=CC=CC=C3F)NC1=O)C4=CC=CC(=C4)C5=CN=CN=C5

Isomeric SMILES

C1C(=NC2=C(C=C(C=C2)C3=CC=CC=C3F)NC1=O)C4=CC=CC(=C4)C5=CN=CN=C5

InChI

InChI=1S/C25H17FN4O/c26-21-7-2-1-6-20(21)17-8-9-22-24(11-17)30-25(31)12-23(29-22)18-5-3-4-16(10-18)19-13-27-15-28-14-19/h1-11,13-15H,12H2,(H,30,31)