2-(3,4-dimethylphenyl)-6-[4-[(5-thiophen-2-yl-1H-pyrazol-3-yl)carbonyl]piperazin-1-yl]pyridazin-3-one

Systemtic Name: 2-(3,4-dimethylphenyl)-6-[4-[(5-thiophen-2-yl-1H-pyrazol-3-yl)carbonyl]piperazin-1-yl]pyridazin-3-one Openeye Name: 2-(3,4-dimethylphenyl)-6-[4-[5-(2-thienyl)-1H-pyrazole-3-carbonyl]piperazin-1-yl]pyridazin-3-one CAS Name: 2-(3,4-dimethylphenyl)-6-[4-[oxo-(5-thiophen-2-yl-1H-pyrazol-3-yl)methyl]-1-piperazinyl]-3-pyridazinone IUPAC Name: 2-(3,4-dimethylphenyl)-6-[4-(5-thiophen-2-yl-1H-pyrazole-3-carbonyl)piperazin-1-yl]pyridazin-3-one Traditional Name: 2-(3,4-dimethylphenyl)-6-[4-[5-(2-thienyl)-1H-pyrazole-3-carbonyl]piperazino]pyridazin-3-one Formula: C24H24N6O2S MolecularWeight: 460.55136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C=CC(=N2)N3CCN(CC3)C(=O)C4=NNC(=C4)C5=CC=CS5)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C=CC(=N2)N3CCN(CC3)C(=O)C4=NNC(=C4)C5=CC=CS5)C

InChI

InChI=1S/C24H24N6O2S/c1-16-5-6-18(14-17(16)2)30-23(31)8-7-22(27-30)28-9-11-29(12-10-28)24(32)20-15-19(25-26-20)21-4-3-13-33-21/h3-8,13-15H,9-12H2,1-2H3,(H,25,26)