1-[4-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl]-3-methyl-butan-1-one

Systemtic Name: 1-[4-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[4-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl]-3-methyl-butan-1-one CAS Name: 1-[4-[6-(2,5-dimethoxyphenyl)-3-pyridazinyl]-1-piperazinyl]-3-methyl-1-butanone IUPAC Name: 1-[4-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl]-3-methylbutan-1-one Traditional Name: 1-[4-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]piperazino]-3-methyl-butan-1-one Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCN(CC1)C2=NN=C(C=C2)C3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CC(C)CC(=O)N1CCN(CC1)C2=NN=C(C=C2)C3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C21H28N4O3/c1-15(2)13-21(26)25-11-9-24(10-12-25)20-8-6-18(22-23-20)17-14-16(27-3)5-7-19(17)28-4/h5-8,14-15H,9-13H2,1-4H3