3-[[2-(5-carbamimidoyl-2-ethoxy-phenoxy)-6-oxidanylidene-5H-pyrimido[4,5-b][1,4]oxazin-4-yl]oxy]-N,N-dimethyl-5-(trifluoromethyl)benzamide

Systemtic Name: 3-[[2-(5-carbamimidoyl-2-ethoxy-phenoxy)-6-oxidanylidene-5H-pyrimido[4,5-b][1,4]oxazin-4-yl]oxy]-N,N-dimethyl-5-(trifluoromethyl)benzamide Openeye Name: 3-[[2-(5-carbamimidoyl-2-ethoxy-phenoxy)-6-oxo-5H-pyrimido[4,5-b][1,4]oxazin-4-yl]oxy]-N,N-dimethyl-5-(trifluoromethyl)benzamide CAS Name: 3-[[2-(5-carbamimidoyl-2-ethoxyphenoxy)-6-oxo-5H-pyrimido[4,5-b][1,4]oxazin-4-yl]oxy]-N,N-dimethyl-5-(trifluoromethyl)benzamide IUPAC Name: 3-[[2-(5-carbamimidoyl-2-ethoxyphenoxy)-6-oxo-5H-pyrimido[4,5-b][1,4]oxazin-4-yl]oxy]-N,N-dimethyl-5-(trifluoromethyl)benzamide Traditional Name: 3-[[2-(5-amidino-2-ethoxy-phenoxy)-6-keto-5H-pyrimido[4,5-b][1,4]oxazin-4-yl]oxy]-N,N-dimethyl-5-(trifluoromethyl)benzamide Formula: C25H23F3N6O6 MolecularWeight: 560.48193

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=N)N)OC2=NC3=C(C(=N2)OC4=CC(=CC(=C4)C(F)(F)F)C(=O)N(C)C)NC(=O)CO3

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=N)N)OC2=NC3=C(C(=N2)OC4=CC(=CC(=C4)C(F)(F)F)C(=O)N(C)C)NC(=O)CO3

InChI

InChI=1S/C25H23F3N6O6/c1-4-37-16-6-5-12(20(29)30)9-17(16)40-24-32-21-19(31-18(35)11-38-21)22(33-24)39-15-8-13(23(36)34(2)3)7-14(10-15)25(26,27)28/h5-10H,4,11H2,1-3H3,(H3,29,30)(H,31,35)