1-(2-oxidanylidenehexyl)-5-pyridazin-3-yl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 1-(2-oxidanylidenehexyl)-5-pyridazin-3-yl-3H-1,4-benzodiazepin-2-one Openeye Name: 1-(2-oxohexyl)-5-pyridazin-3-yl-3H-1,4-benzodiazepin-2-one CAS Name: 1-(2-oxohexyl)-5-(3-pyridazinyl)-3H-1,4-benzodiazepin-2-one IUPAC Name: 1-(2-oxohexyl)-5-pyridazin-3-yl-3H-1,4-benzodiazepin-2-one Traditional Name: 1-(2-ketohexyl)-5-pyridazin-3-yl-3H-1,4-benzodiazepin-2-one Formula: C19H20N4O2 MolecularWeight: 336.3877

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)CN1C(=O)CN=C(C2=CC=CC=C21)C3=NN=CC=C3

Isomeric SMILES

CCCCC(=O)CN1C(=O)CN=C(C2=CC=CC=C21)C3=NN=CC=C3

InChI

InChI=1S/C19H20N4O2/c1-2-3-7-14(24)13-23-17-10-5-4-8-15(17)19(20-12-18(23)25)16-9-6-11-21-22-16/h4-6,8-11H,2-3,7,12-13H2,1H3