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

Systemtic Name: 2-(4-chloranyl-3,5-dimethyl-phenoxy)-1-[4-(6-phenylpyridazin-3-yl)piperazin-1-yl]ethanone Openeye Name: 2-(4-chloro-3,5-dimethyl-phenoxy)-1-[4-(6-phenylpyridazin-3-yl)piperazin-1-yl]ethanone CAS Name: 2-(4-chloro-3,5-dimethylphenoxy)-1-[4-(6-phenyl-3-pyridazinyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-chloro-3,5-dimethylphenoxy)-1-[4-(6-phenylpyridazin-3-yl)piperazin-1-yl]ethanone Traditional Name: 2-(4-chloro-3,5-dimethyl-phenoxy)-1-[4-(6-phenylpyridazin-3-yl)piperazino]ethanone Formula: C24H25ClN4O2 MolecularWeight: 436.9339

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCC(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCC(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H25ClN4O2/c1-17-14-20(15-18(2)24(17)25)31-16-23(30)29-12-10-28(11-13-29)22-9-8-21(26-27-22)19-6-4-3-5-7-19/h3-9,14-15H,10-13,16H2,1-2H3