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

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-5-bromanyl-2-fluoranyl-N-methyl-benzamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-5-bromo-2-fluoro-N-methyl-benzamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-5-bromo-2-fluoro-N-methylbenzamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-5-bromo-2-fluoro-N-methylbenzamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-5-bromo-2-fluoro-N-methyl-benzamide Formula: C16H18BrFN4O3 MolecularWeight: 413.241523

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18BrFN4O3/c1-3-4-7-22-13(19)12(14(23)20-16(22)25)21(2)15(24)10-8-9(17)5-6-11(10)18/h5-6,8H,3-4,7,19H2,1-2H3,(H,20,23,25)