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

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-(4-bromanyl-2-fluoranyl-phenoxy)-N-butyl-ethanamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-2-(4-bromo-2-fluoro-phenoxy)-N-butyl-acetamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-2-(4-bromo-2-fluorophenoxy)-N-butylacetamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-2-(4-bromo-2-fluorophenoxy)-N-butylacetamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-2-(4-bromo-2-fluoro-phenoxy)-N-butyl-acetamide Formula: C20H26BrFN4O4 MolecularWeight: 485.347243

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)COC2=C(C=C(C=C2)Br)F)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)COC2=C(C=C(C=C2)Br)F)N

InChI

InChI=1S/C20H26BrFN4O4/c1-3-5-9-25(16(27)12-30-15-8-7-13(21)11-14(15)22)17-18(23)26(10-6-4-2)20(29)24-19(17)28/h7-8,11H,3-6,9-10,12,23H2,1-2H3,(H,24,28,29)