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

Systemtic Name: 6-methyl-11-[2-(4-methylpiperazin-1-yl)ethanoyl]pyrimido[4,5-b][1,5]benzodiazepin-5-one Openeye Name: 6-methyl-11-[2-(4-methylpiperazin-1-yl)acetyl]pyrimido[4,5-b][1,5]benzodiazepin-5-one CAS Name: 6-methyl-11-[2-(4-methyl-1-piperazinyl)-1-oxoethyl]-5-pyrimido[4,5-b][1,5]benzodiazepinone IUPAC Name: 6-methyl-11-[2-(4-methylpiperazin-1-yl)acetyl]pyrimido[4,5-b][1,5]benzodiazepin-5-one Traditional Name: 6-methyl-11-[2-(4-methylpiperazino)acetyl]pyrimido[4,5-b][1,5]benzodiazepin-5-one Formula: C19H22N6O2 MolecularWeight: 366.41698

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC(=O)N2C3=CC=CC=C3N(C(=O)C4=CN=CN=C42)C

Isomeric SMILES

CN1CCN(CC1)CC(=O)N2C3=CC=CC=C3N(C(=O)C4=CN=CN=C42)C

InChI

InChI=1S/C19H22N6O2/c1-22-7-9-24(10-8-22)12-17(26)25-16-6-4-3-5-15(16)23(2)19(27)14-11-20-13-21-18(14)25/h3-6,11,13H,7-10,12H2,1-2H3