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

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-(2-bromanyl-4-fluoranyl-phenoxy)-N-ethyl-ethanamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-2-(2-bromo-4-fluoro-phenoxy)-N-ethyl-acetamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-2-(2-bromo-4-fluorophenoxy)-N-ethylacetamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-2-(2-bromo-4-fluorophenoxy)-N-ethylacetamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-2-(2-bromo-4-fluoro-phenoxy)-N-ethyl-acetamide Formula: C18H22BrFN4O4 MolecularWeight: 457.294083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22BrFN4O4/c1-3-5-8-24-16(21)15(17(26)22-18(24)27)23(4-2)14(25)10-28-13-7-6-11(20)9-12(13)19/h6-7,9H,3-5,8,10,21H2,1-2H3,(H,22,26,27)