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2-methyl-4-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]carbonyl-phthalazin-1-one

2-methyl-4-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]carbonyl-phthalazin-1-one

Systemtic Name:2-methyl-4-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]carbonyl-phthalazin-1-one
Openeye Name:2-methyl-4-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbonyl]phthalazin-1-one
CAS Name:2-methyl-4-[oxo-[4-[2-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]methyl]-1-phthalazinone
IUPAC Name:2-methyl-4-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbonyl]phthalazin-1-one
Traditional Name:2-methyl-4-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbonyl]phthalazin-1-one
Formula: C21H19F3N4O4S
MolecularWeight: 480.46017
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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C(F)(F)F


Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C(F)(F)F


InChI

InChI=1S/C21H19F3N4O4S/c1-26-19(29)15-7-3-2-6-14(15)18(25-26)20(30)27-10-12-28(13-11-27)33(31,32)17-9-5-4-8-16(17)21(22,23)24/h2-9H,10-13H2,1H3


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