N-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)methyl]-6-(trifluoromethyl)pyrimidine-4-carboxamide

Systemtic Name: N-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)methyl]-6-(trifluoromethyl)pyrimidine-4-carboxamide Openeye Name: N-[(3-oxo-4H-1,4-benzoxazin-6-yl)methyl]-6-(trifluoromethyl)pyrimidine-4-carboxamide CAS Name: N-[(3-oxo-4H-1,4-benzoxazin-6-yl)methyl]-6-(trifluoromethyl)-4-pyrimidinecarboxamide IUPAC Name: N-[(3-oxo-4H-1,4-benzoxazin-6-yl)methyl]-6-(trifluoromethyl)pyrimidine-4-carboxamide Traditional Name: N-[(3-keto-4H-1,4-benzoxazin-6-yl)methyl]-6-(trifluoromethyl)pyrimidine-4-carboxamide Formula: C15H11F3N4O3 MolecularWeight: 352.26805

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(O1)C=CC(=C2)CNC(=O)C3=CC(=NC=N3)C(F)(F)F

Isomeric SMILES

C1C(=O)NC2=C(O1)C=CC(=C2)CNC(=O)C3=CC(=NC=N3)C(F)(F)F

InChI

InChI=1S/C15H11F3N4O3/c16-15(17,18)12-4-10(20-7-21-12)14(24)19-5-8-1-2-11-9(3-8)22-13(23)6-25-11/h1-4,7H,5-6H2,(H,19,24)(H,22,23)