5-chloranyl-4-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-1H-pyridazin-6-one

Systemtic Name: 5-chloranyl-4-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-1H-pyridazin-6-one Openeye Name: 5-chloro-4-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-1H-pyridazin-6-one CAS Name: 5-chloro-4-[4-[4-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]-1H-pyridazin-6-one IUPAC Name: 5-chloro-4-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-1H-pyridazin-6-one Traditional Name: 5-chloro-4-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazino]-1H-pyridazin-6-one Formula: C15H14ClF3N4O3S MolecularWeight: 422.80987

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)NN=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)NN=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C15H14ClF3N4O3S/c16-13-12(9-20-21-14(13)24)22-5-7-23(8-6-22)27(25,26)11-3-1-10(2-4-11)15(17,18)19/h1-4,9H,5-8H2,(H,21,24)