N-methyl-4-oxidanyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxamide

Systemtic Name: N-methyl-4-oxidanyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxamide Openeye Name: 4-hydroxy-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-1-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxamide CAS Name: 4-hydroxy-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-1-[2-(trifluoromethyl)phenyl]-3-pyrazolecarboxamide IUPAC Name: 4-hydroxy-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-1-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxamide Traditional Name: 4-hydroxy-N-[(4-keto-1H-quinazolin-2-yl)methyl]-N-methyl-1-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxamide Formula: C21H16F3N5O3 MolecularWeight: 443.37865

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=NN(C=C3O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=NN(C=C3O)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C21H16F3N5O3/c1-28(11-17-25-14-8-4-2-6-12(14)19(31)26-17)20(32)18-16(30)10-29(27-18)15-9-5-3-7-13(15)21(22,23)24/h2-10,30H,11H2,1H3,(H,25,26,31)