N-(3-methoxypropyl)-4-oxidanylidene-3-[3-(trifluoromethyl)phenyl]quinazoline-7-carboxamide

Systemtic Name: N-(3-methoxypropyl)-4-oxidanylidene-3-[3-(trifluoromethyl)phenyl]quinazoline-7-carboxamide Openeye Name: N-(3-methoxypropyl)-4-oxo-3-[3-(trifluoromethyl)phenyl]quinazoline-7-carboxamide CAS Name: N-(3-methoxypropyl)-4-oxo-3-[3-(trifluoromethyl)phenyl]-7-quinazolinecarboxamide IUPAC Name: N-(3-methoxypropyl)-4-oxo-3-[3-(trifluoromethyl)phenyl]quinazoline-7-carboxamide Traditional Name: 4-keto-N-(3-methoxypropyl)-3-[3-(trifluoromethyl)phenyl]quinazoline-7-carboxamide Formula: C20H18F3N3O3 MolecularWeight: 405.37043

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C=N2)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

COCCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C=N2)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C20H18F3N3O3/c1-29-9-3-8-24-18(27)13-6-7-16-17(10-13)25-12-26(19(16)28)15-5-2-4-14(11-15)20(21,22)23/h2,4-7,10-12H,3,8-9H2,1H3,(H,24,27)