1-[4-(6-phenylpyridazin-3-yl)piperazin-1-yl]-2-(2,3,5-trimethylphenoxy)ethanone

Systemtic Name: 1-[4-(6-phenylpyridazin-3-yl)piperazin-1-yl]-2-(2,3,5-trimethylphenoxy)ethanone Openeye Name: 1-[4-(6-phenylpyridazin-3-yl)piperazin-1-yl]-2-(2,3,5-trimethylphenoxy)ethanone CAS Name: 1-[4-(6-phenyl-3-pyridazinyl)-1-piperazinyl]-2-(2,3,5-trimethylphenoxy)ethanone IUPAC Name: 1-[4-(6-phenylpyridazin-3-yl)piperazin-1-yl]-2-(2,3,5-trimethylphenoxy)ethanone Traditional Name: 1-[4-(6-phenylpyridazin-3-yl)piperazino]-2-(2,3,5-trimethylphenoxy)ethanone Formula: C25H28N4O2 MolecularWeight: 416.51542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OCC(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CC=CC=C4)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OCC(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CC=CC=C4)C)C

InChI

InChI=1S/C25H28N4O2/c1-18-15-19(2)20(3)23(16-18)31-17-25(30)29-13-11-28(12-14-29)24-10-9-22(26-27-24)21-7-5-4-6-8-21/h4-10,15-16H,11-14,17H2,1-3H3