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

Systemtic Name: 2-(2,5-dimethylphenoxy)-1-[4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl]propan-1-one Openeye Name: 2-(2,5-dimethylphenoxy)-1-[4-[6-(p-tolyl)pyridazin-3-yl]piperazin-1-yl]propan-1-one CAS Name: 2-(2,5-dimethylphenoxy)-1-[4-[6-(4-methylphenyl)-3-pyridazinyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-(2,5-dimethylphenoxy)-1-[4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl]propan-1-one Traditional Name: 2-(2,5-dimethylphenoxy)-1-[4-[6-(p-tolyl)pyridazin-3-yl]piperazino]propan-1-one Formula: C26H30N4O2 MolecularWeight: 430.542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(C=C2)N3CCN(CC3)C(=O)C(C)OC4=C(C=CC(=C4)C)C

Isomeric SMILES

CC1=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/C26H30N4O2/c1-18-6-9-22(10-7-18)23-11-12-25(28-27-23)29-13-15-30(16-14-29)26(31)21(4)32-24-17-19(2)5-8-20(24)3/h5-12,17,21H,13-16H2,1-4H3