3-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl-propyl-carbamoyl]-6-(trifluoromethyl)pyridin-2-olate

Systemtic Name: 3-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl-propyl-carbamoyl]-6-(trifluoromethyl)pyridin-2-olate Openeye Name: 3-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-propyl-carbamoyl]-6-(trifluoromethyl)pyridin-2-olate CAS Name: 3-[[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-propylamino]-oxomethyl]-6-(trifluoromethyl)-2-pyridinolate IUPAC Name: 3-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-propylcarbamoyl]-6-(trifluoromethyl)pyridin-2-olate Traditional Name: 3-[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl-propyl-carbamoyl]-6-(trifluoromethyl)pyridin-2-olate Formula: C19H15ClF3N4O3- MolecularWeight: 439.79561

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=O)C3=C(N=C(C=C3)C(F)(F)F)[O-]

Isomeric SMILES

CCCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=O)C3=C(N=C(C=C3)C(F)(F)F)[O-]

InChI

InChI=1S/C19H16ClF3N4O3/c1-2-7-27(18(30)12-5-6-14(19(21,22)23)25-17(12)29)9-15-24-13-8-10(20)3-4-11(13)16(28)26-15/h3-6,8H,2,7,9H2,1H3,(H,25,29)(H,24,26,28)/p-1