11-[2-(4-methylpiperazin-1-yl)ethanoyl]-6H-pyrimido[4,5-b][1,5]benzodiazepin-5-one

Systemtic Name: 11-[2-(4-methylpiperazin-1-yl)ethanoyl]-6H-pyrimido[4,5-b][1,5]benzodiazepin-5-one Openeye Name: 11-[2-(4-methylpiperazin-1-yl)acetyl]-6H-pyrimido[4,5-b][1,5]benzodiazepin-5-one CAS Name: 11-[2-(4-methyl-1-piperazinyl)-1-oxoethyl]-6H-pyrimido[4,5-b][1,5]benzodiazepin-5-one IUPAC Name: 11-[2-(4-methylpiperazin-1-yl)acetyl]-6H-pyrimido[4,5-b][1,5]benzodiazepin-5-one Traditional Name: 11-[2-(4-methylpiperazino)acetyl]-6H-pyrimido[4,5-b][1,5]benzodiazepin-5-one Formula: C18H20N6O2 MolecularWeight: 352.3904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC(=O)N2C3=CC=CC=C3NC(=O)C4=CN=CN=C42

Isomeric SMILES

CN1CCN(CC1)CC(=O)N2C3=CC=CC=C3NC(=O)C4=CN=CN=C42

InChI

InChI=1S/C18H20N6O2/c1-22-6-8-23(9-7-22)11-16(25)24-15-5-3-2-4-14(15)21-18(26)13-10-19-12-20-17(13)24/h2-5,10,12H,6-9,11H2,1H3,(H,21,26)