3-chloranyl-2-[5-ethanoyl-6-oxidanylidene-4-(trifluoromethyl)pyrimidin-1-yl]-5-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 3-chloranyl-2-[5-ethanoyl-6-oxidanylidene-4-(trifluoromethyl)pyrimidin-1-yl]-5-(trifluoromethyl)benzenecarbonitrile Openeye Name: 2-[5-acetyl-6-oxo-4-(trifluoromethyl)pyrimidin-1-yl]-3-chloro-5-(trifluoromethyl)benzonitrile CAS Name: 2-[5-acetyl-6-oxo-4-(trifluoromethyl)-1-pyrimidinyl]-3-chloro-5-(trifluoromethyl)benzonitrile IUPAC Name: 2-[5-acetyl-6-oxo-4-(trifluoromethyl)pyrimidin-1-yl]-3-chloro-5-(trifluoromethyl)benzonitrile Traditional Name: 2-[5-acetyl-6-keto-4-(trifluoromethyl)pyrimidin-1-yl]-3-chloro-5-(trifluoromethyl)benzonitrile Formula: C15H6ClF6N3O2 MolecularWeight: 409.670459

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N=CN(C1=O)C2=C(C=C(C=C2C#N)C(F)(F)F)Cl)C(F)(F)F

Isomeric SMILES

CC(=O)C1=C(N=CN(C1=O)C2=C(C=C(C=C2C#N)C(F)(F)F)Cl)C(F)(F)F

InChI

InChI=1S/C15H6ClF6N3O2/c1-6(26)10-12(15(20,21)22)24-5-25(13(10)27)11-7(4-23)2-8(3-9(11)16)14(17,18)19/h2-3,5H,1H3