6-(3,5-dimethylpyrazol-1-yl)-2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]pyridazin-3-one

Systemtic Name: 6-(3,5-dimethylpyrazol-1-yl)-2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]pyridazin-3-one Openeye Name: 6-(3,5-dimethylpyrazol-1-yl)-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]pyridazin-3-one CAS Name: 6-(3,5-dimethyl-1-pyrazolyl)-2-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-pyridazinone IUPAC Name: 6-(3,5-dimethylpyrazol-1-yl)-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]pyridazin-3-one Traditional Name: 6-(3,5-dimethylpyrazol-1-yl)-2-[2-keto-2-(4-phenylpiperazino)ethyl]pyridazin-3-one Formula: C21H24N6O2 MolecularWeight: 392.45426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NN(C(=O)C=C2)CC(=O)N3CCN(CC3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NN1C2=NN(C(=O)C=C2)CC(=O)N3CCN(CC3)C4=CC=CC=C4)C

InChI

InChI=1S/C21H24N6O2/c1-16-14-17(2)27(22-16)19-8-9-20(28)26(23-19)15-21(29)25-12-10-24(11-13-25)18-6-4-3-5-7-18/h3-9,14H,10-13,15H2,1-2H3