2-azanyl-4-[6-[bis(fluoranyl)methyl]-5-chloranyl-pyrimidin-4-yl]-6-ethanoyl-3-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-azanyl-4-[6-[bis(fluoranyl)methyl]-5-chloranyl-pyrimidin-4-yl]-6-ethanoyl-3-fluoranyl-benzenecarbonitrile Openeye Name: 6-acetyl-2-amino-4-[5-chloro-6-(difluoromethyl)pyrimidin-4-yl]-3-fluoro-benzonitrile CAS Name: 6-acetyl-2-amino-4-[5-chloro-6-(difluoromethyl)-4-pyrimidinyl]-3-fluorobenzonitrile IUPAC Name: 6-acetyl-2-amino-4-[5-chloro-6-(difluoromethyl)pyrimidin-4-yl]-3-fluorobenzonitrile Traditional Name: 6-acetyl-2-amino-4-[5-chloro-6-(difluoromethyl)pyrimidin-4-yl]-3-fluoro-benzonitrile Formula: C14H8ClF3N4O MolecularWeight: 340.68773

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=C(C(=C1)C2=C(C(=NC=N2)C(F)F)Cl)F)N)C#N

Isomeric SMILES

CC(=O)C1=C(C(=C(C(=C1)C2=C(C(=NC=N2)C(F)F)Cl)F)N)C#N

InChI

InChI=1S/C14H8ClF3N4O/c1-5(23)6-2-7(10(16)11(20)8(6)3-19)12-9(15)13(14(17)18)22-4-21-12/h2,4,14H,20H2,1H3