6-[3,5-bis(chloranyl)-4-methyl-phenyl]-2-[(4-phenylpiperazin-1-yl)methyl]pyridazin-3-one

Systemtic Name: 6-[3,5-bis(chloranyl)-4-methyl-phenyl]-2-[(4-phenylpiperazin-1-yl)methyl]pyridazin-3-one Openeye Name: 6-(3,5-dichloro-4-methyl-phenyl)-2-[(4-phenylpiperazin-1-yl)methyl]pyridazin-3-one CAS Name: 6-(3,5-dichloro-4-methylphenyl)-2-[(4-phenyl-1-piperazinyl)methyl]-3-pyridazinone IUPAC Name: 6-(3,5-dichloro-4-methylphenyl)-2-[(4-phenylpiperazin-1-yl)methyl]pyridazin-3-one Traditional Name: 6-(3,5-dichloro-4-methyl-phenyl)-2-[(4-phenylpiperazino)methyl]pyridazin-3-one Formula: C22H22Cl2N4O MolecularWeight: 429.34228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1Cl)C2=NN(C(=O)C=C2)CN3CCN(CC3)C4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1Cl)C2=NN(C(=O)C=C2)CN3CCN(CC3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C22H22Cl2N4O/c1-16-19(23)13-17(14-20(16)24)21-7-8-22(29)28(25-21)15-26-9-11-27(12-10-26)18-5-3-2-4-6-18/h2-8,13-14H,9-12,15H2,1H3