2-[4-(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)piperazin-1-ium-1-yl]-N-[(4-fluorophenyl)methyl]-N-methyl-ethanamide

Systemtic Name: 2-[4-(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)piperazin-1-ium-1-yl]-N-[(4-fluorophenyl)methyl]-N-methyl-ethanamide Openeye Name: 2-[4-(5-chloro-6-oxo-1-phenyl-pyridazin-4-yl)piperazin-1-ium-1-yl]-N-[(4-fluorophenyl)methyl]-N-methyl-acetamide CAS Name: 2-[4-(5-chloro-6-oxo-1-phenyl-4-pyridazinyl)-1-piperazin-1-iumyl]-N-[(4-fluorophenyl)methyl]-N-methylacetamide IUPAC Name: 2-[4-(5-chloro-6-oxo-1-phenylpyridazin-4-yl)piperazin-1-ium-1-yl]-N-[(4-fluorophenyl)methyl]-N-methylacetamide Traditional Name: 2-[4-(5-chloro-6-keto-1-phenyl-pyridazin-4-yl)piperazin-1-ium-1-yl]-N-(4-fluorobenzyl)-N-methyl-acetamide Formula: C24H26ClFN5O2+ MolecularWeight: 470.946943

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)F)C(=O)C[NH+]2CCN(CC2)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl

Isomeric SMILES

CN(CC1=CC=C(C=C1)F)C(=O)C[NH+]2CCN(CC2)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C24H25ClFN5O2/c1-28(16-18-7-9-19(26)10-8-18)22(32)17-29-11-13-30(14-12-29)21-15-27-31(24(33)23(21)25)20-5-3-2-4-6-20/h2-10,15H,11-14,16-17H2,1H3/p+1