N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-5-bromanyl-2-chloranyl-N-(3-methylbutyl)benzamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-5-bromanyl-2-chloranyl-N-(3-methylbutyl)benzamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-5-bromo-2-chloro-N-isopentyl-benzamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-5-bromo-2-chloro-N-(3-methylbutyl)benzamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-5-bromo-2-chloro-N-(3-methylbutyl)benzamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-5-bromo-2-chloro-N-isoamyl-benzamide Formula: C20H26BrClN4O3 MolecularWeight: 485.80244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCC(C)C)C(=O)C2=C(C=CC(=C2)Br)Cl)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCC(C)C)C(=O)C2=C(C=CC(=C2)Br)Cl)N

InChI

InChI=1S/C20H26BrClN4O3/c1-4-5-9-26-17(23)16(18(27)24-20(26)29)25(10-8-12(2)3)19(28)14-11-13(21)6-7-15(14)22/h6-7,11-12H,4-5,8-10,23H2,1-3H3,(H,24,27,29)