6-methyl-3-(4-methylsulfonylpiperazin-1-yl)carbonyl-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one

Systemtic Name: 6-methyl-3-(4-methylsulfonylpiperazin-1-yl)carbonyl-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one Openeye Name: 6-methyl-3-(4-methylsulfonylpiperazine-1-carbonyl)-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one CAS Name: 6-methyl-3-[(4-methylsulfonyl-1-piperazinyl)-oxomethyl]-1-[2-(trifluoromethyl)phenyl]-4-pyridazinone IUPAC Name: 6-methyl-3-(4-methylsulfonylpiperazine-1-carbonyl)-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one Traditional Name: 3-(4-mesylpiperazine-1-carbonyl)-6-methyl-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one Formula: C18H19F3N4O4S MolecularWeight: 444.42807

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2C(F)(F)F)C(=O)N3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2C(F)(F)F)C(=O)N3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C18H19F3N4O4S/c1-12-11-15(26)16(17(27)23-7-9-24(10-8-23)30(2,28)29)22-25(12)14-6-4-3-5-13(14)18(19,20)21/h3-6,11H,7-10H2,1-2H3