2-[2-[4-(2-methyl-6-piperidin-1-yl-pyrimidin-4-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]pyridazin-3-one

Systemtic Name: 2-[2-[4-(2-methyl-6-piperidin-1-yl-pyrimidin-4-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]pyridazin-3-one Openeye Name: 2-[2-[4-[2-methyl-6-(1-piperidyl)pyrimidin-4-yl]piperazin-1-yl]-2-oxo-ethyl]pyridazin-3-one CAS Name: 2-[2-[4-[2-methyl-6-(1-piperidinyl)-4-pyrimidinyl]-1-piperazinyl]-2-oxoethyl]-3-pyridazinone IUPAC Name: 2-[2-[4-(2-methyl-6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]-2-oxoethyl]pyridazin-3-one Traditional Name: 2-[2-keto-2-[4-(2-methyl-6-piperidino-pyrimidin-4-yl)piperazino]ethyl]pyridazin-3-one Formula: C20H27N7O2 MolecularWeight: 397.47408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)N2CCN(CC2)C(=O)CN3C(=O)C=CC=N3)N4CCCCC4

Isomeric SMILES

CC1=NC(=CC(=N1)N2CCN(CC2)C(=O)CN3C(=O)C=CC=N3)N4CCCCC4

InChI

InChI=1S/C20H27N7O2/c1-16-22-17(24-8-3-2-4-9-24)14-18(23-16)25-10-12-26(13-11-25)20(29)15-27-19(28)6-5-7-21-27/h5-7,14H,2-4,8-13,15H2,1H3