CAS 1798004-50-8 Diclazuril 6-Carboxylic Acid Butyl Ester - Analytical Products / Alfa Chemistry

CAT	APS1798004508
CAS	1798004-50-8
Structure
Synonyms	1,2,4-Triazine-6-carboxylic acid, 2-[3,5-dichloro-4-[(4-chlorophenyl)cyanomethyl]phenyl]-2,3,4,5-tetrahydro-3,5-dioxo-, butyl ester, Butyl 2-[3,5-dichloro-4-[(RS)-(4-chlorophenyl)cyanomethyl]phenyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxylate
IUPAC Name	butyl 2-[3,5-dichloro-4-[(4-chlorophenyl)-cyanomethyl]phenyl]-3,5-dioxo-1,2,4-triazine-6-carboxylate
Molecular Weight	507.75
Molecular Formula	C22H17Cl3N4O4
Canonical SMILES	CCCCOC(=O)C1=NN(C(=O)NC1=O)c2cc(Cl)c(C(C#N)c3ccc(Cl)cc3)c(Cl)c2
InChI	InChI=1S/C22H17Cl3N4O4/c1-2-3-8-33-21(31)19-20(30)27-22(32)29(28-19)14-9-16(24)18(17(25)10-14)15(11-26)12-4-6-13(23)7-5-12/h4-7,9-10,15H,2-3,8H2,1H3,(H,27,30,32)

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