4-(4-oxidanylidenequinazolin-3-yl)-N-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]butanamide

Systemtic Name: 4-(4-oxidanylidenequinazolin-3-yl)-N-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]butanamide Openeye Name: 4-(4-oxoquinazolin-3-yl)-N-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]butanamide CAS Name: 4-(4-oxo-3-quinazolinyl)-N-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]butanamide IUPAC Name: 4-(4-oxoquinazolin-3-yl)-N-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]butanamide Traditional Name: 4-(4-ketoquinazolin-3-yl)-N-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]butyramide Formula: C15H13F3N6O2 MolecularWeight: 366.29793

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C=N2)CCCC(=O)NC3=NNC(=N3)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C=N2)CCCC(=O)NC3=NNC(=N3)C(F)(F)F

InChI

InChI=1S/C15H13F3N6O2/c16-15(17,18)13-21-14(23-22-13)20-11(25)6-3-7-24-8-19-10-5-2-1-4-9(10)12(24)26/h1-2,4-5,8H,3,6-7H2,(H2,20,21,22,23,25)