N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-(3-bromanylphenoxy)-N-butyl-ethanamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-(3-bromanylphenoxy)-N-butyl-ethanamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-2-(3-bromophenoxy)-N-butyl-acetamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-2-(3-bromophenoxy)-N-butylacetamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-2-(3-bromophenoxy)-N-butylacetamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-2-(3-bromophenoxy)-N-butyl-acetamide Formula: C20H27BrN4O4 MolecularWeight: 467.35678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27BrN4O4/c1-3-5-10-24(16(26)13-29-15-9-7-8-14(21)12-15)17-18(22)25(11-6-4-2)20(28)23-19(17)27/h7-9,12H,3-6,10-11,13,22H2,1-2H3,(H,23,27,28)