4,5-bis(chloranyl)-2-[[4-(2-methyl-2-phenyl-propanoyl)piperazin-1-yl]methyl]pyridazin-3-one

Systemtic Name: 4,5-bis(chloranyl)-2-[[4-(2-methyl-2-phenyl-propanoyl)piperazin-1-yl]methyl]pyridazin-3-one Openeye Name: 4,5-dichloro-2-[[4-(2-methyl-2-phenyl-propanoyl)piperazin-1-yl]methyl]pyridazin-3-one CAS Name: 4,5-dichloro-2-[[4-(2-methyl-1-oxo-2-phenylpropyl)-1-piperazinyl]methyl]-3-pyridazinone IUPAC Name: 4,5-dichloro-2-[[4-(2-methyl-2-phenylpropanoyl)piperazin-1-yl]methyl]pyridazin-3-one Traditional Name: 4,5-dichloro-2-[[4-(2-methyl-2-phenyl-propanoyl)piperazino]methyl]pyridazin-3-one Formula: C19H22Cl2N4O2 MolecularWeight: 409.30958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C(=O)N2CCN(CC2)CN3C(=O)C(=C(C=N3)Cl)Cl

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C(=O)N2CCN(CC2)CN3C(=O)C(=C(C=N3)Cl)Cl

InChI

InChI=1S/C19H22Cl2N4O2/c1-19(2,14-6-4-3-5-7-14)18(27)24-10-8-23(9-11-24)13-25-17(26)16(21)15(20)12-22-25/h3-7,12H,8-11,13H2,1-2H3