3-diazanyl-5-(2-diethoxyphosphorylethanoyl)-6-(4-methyl-2-phenyl-imidazol-1-yl)-1-oxidanyl-7-(trifluoromethyl)quinoxalin-2-one

Systemtic Name: 3-diazanyl-5-(2-diethoxyphosphorylethanoyl)-6-(4-methyl-2-phenyl-imidazol-1-yl)-1-oxidanyl-7-(trifluoromethyl)quinoxalin-2-one Openeye Name: 5-(2-diethoxyphosphorylacetyl)-3-hydrazino-1-hydroxy-6-(4-methyl-2-phenyl-imidazol-1-yl)-7-(trifluoromethyl)quinoxalin-2-one CAS Name: 5-(2-diethoxyphosphoryl-1-oxoethyl)-3-hydrazinyl-1-hydroxy-6-(4-methyl-2-phenyl-1-imidazolyl)-7-(trifluoromethyl)-2-quinoxalinone IUPAC Name: 5-(2-diethoxyphosphorylacetyl)-3-hydrazinyl-1-hydroxy-6-(4-methyl-2-phenylimidazol-1-yl)-7-(trifluoromethyl)quinoxalin-2-one Traditional Name: 5-(2-diethoxyphosphorylacetyl)-3-hydrazino-1-hydroxy-6-(4-methyl-2-phenyl-imidazol-1-yl)-7-(trifluoromethyl)quinoxalin-2-one Formula: C25H26F3N6O6P MolecularWeight: 594.479511

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CC(=O)C1=C(C(=CC2=C1N=C(C(=O)N2O)NN)C(F)(F)F)N3C=C(N=C3C4=CC=CC=C4)C)OCC

Isomeric SMILES

CCOP(=O)(CC(=O)C1=C(C(=CC2=C1N=C(C(=O)N2O)NN)C(F)(F)F)N3C=C(N=C3C4=CC=CC=C4)C)OCC

InChI

InChI=1S/C25H26F3N6O6P/c1-4-39-41(38,40-5-2)13-18(35)19-20-17(34(37)24(36)22(31-20)32-29)11-16(25(26,27)28)21(19)33-12-14(3)30-23(33)15-9-7-6-8-10-15/h6-12,37H,4-5,13,29H2,1-3H3,(H,31,32)