2-(2,5-dimethylphenoxy)-1-[4-[6-(4-ethoxyphenyl)pyridazin-3-yl]piperazin-1-yl]propan-1-one

Systemtic Name: 2-(2,5-dimethylphenoxy)-1-[4-[6-(4-ethoxyphenyl)pyridazin-3-yl]piperazin-1-yl]propan-1-one Openeye Name: 2-(2,5-dimethylphenoxy)-1-[4-[6-(4-ethoxyphenyl)pyridazin-3-yl]piperazin-1-yl]propan-1-one CAS Name: 2-(2,5-dimethylphenoxy)-1-[4-[6-(4-ethoxyphenyl)-3-pyridazinyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-(2,5-dimethylphenoxy)-1-[4-[6-(4-ethoxyphenyl)pyridazin-3-yl]piperazin-1-yl]propan-1-one Traditional Name: 2-(2,5-dimethylphenoxy)-1-[4-(6-p-phenetylpyridazin-3-yl)piperazino]propan-1-one Formula: C27H32N4O3 MolecularWeight: 460.56798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN=C(C=C2)N3CCN(CC3)C(=O)C(C)OC4=C(C=CC(=C4)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN=C(C=C2)N3CCN(CC3)C(=O)C(C)OC4=C(C=CC(=C4)C)C

InChI

InChI=1S/C27H32N4O3/c1-5-33-23-10-8-22(9-11-23)24-12-13-26(29-28-24)30-14-16-31(17-15-30)27(32)21(4)34-25-18-19(2)6-7-20(25)3/h6-13,18,21H,5,14-17H2,1-4H3