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2-methyl-4-[[2-[3-(trifluoromethyl)phenyl]imino-1,3-thiazinan-3-yl]carbonyl]phthalazin-1-one

2-methyl-4-[[2-[3-(trifluoromethyl)phenyl]imino-1,3-thiazinan-3-yl]carbonyl]phthalazin-1-one

Systemtic Name:2-methyl-4-[[2-[3-(trifluoromethyl)phenyl]imino-1,3-thiazinan-3-yl]carbonyl]phthalazin-1-one
Openeye Name:2-methyl-4-[2-[3-(trifluoromethyl)phenyl]imino-1,3-thiazinane-3-carbonyl]phthalazin-1-one
CAS Name:2-methyl-4-[oxo-[2-[3-(trifluoromethyl)phenyl]imino-1,3-thiazinan-3-yl]methyl]-1-phthalazinone
IUPAC Name:2-methyl-4-[2-[3-(trifluoromethyl)phenyl]imino-1,3-thiazinane-3-carbonyl]phthalazin-1-one
Traditional Name:2-methyl-4-[2-[3-(trifluoromethyl)phenyl]imino-1,3-thiazinane-3-carbonyl]phthalazin-1-one
Formula: C21H17F3N4O2S
MolecularWeight: 446.44549
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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCCSC3=NC4=CC=CC(=C4)C(F)(F)F


Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCCSC3=NC4=CC=CC(=C4)C(F)(F)F


InChI

InChI=1S/C21H17F3N4O2S/c1-27-18(29)16-9-3-2-8-15(16)17(26-27)19(30)28-10-5-11-31-20(28)25-14-7-4-6-13(12-14)21(22,23)24/h2-4,6-9,12H,5,10-11H2,1H3


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