N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-N-ethyl-2-(5-fluoranyl-2-nitro-phenoxy)ethanamide

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-N-ethyl-2-(5-fluoranyl-2-nitro-phenoxy)ethanamide Openeye Name: N-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-N-ethyl-2-(5-fluoro-2-nitro-phenoxy)acetamide CAS Name: N-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-N-ethyl-2-(5-fluoro-2-nitrophenoxy)acetamide IUPAC Name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-N-ethyl-2-(5-fluoro-2-nitrophenoxy)acetamide Traditional Name: N-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-N-ethyl-2-(5-fluoro-2-nitro-phenoxy)acetamide Formula: C21H20FN5O6 MolecularWeight: 457.411803

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)COC3=C(C=CC(=C3)F)[N+](=O)[O-]

Isomeric SMILES

CCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)COC3=C(C=CC(=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C21H20FN5O6/c1-2-25(17(28)12-33-16-10-14(22)8-9-15(16)27(31)32)18-19(23)26(21(30)24-20(18)29)11-13-6-4-3-5-7-13/h3-10H,2,11-12,23H2,1H3,(H,24,29,30)