1-(2-Chlorophenyl)sulfonyl-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea;methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate

HCID 184012

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Basic information

CAS: 108823-51-4
Standard SMILES: COC(=O)C(C)Oc1ccc(Oc2ccc(Cl)cc2Cl)cc1.COc1nc(C)nc(NC(=O)NS(=O)(=O)c2ccccc2Cl)n1
InChIKey: NAZLKKFUHQSMRP-UHFFFAOYSA-N
Molecular formula: C28H26Cl3N5O8S
Average molar mass: 699 g/mol
Monoisotopic mass: 697.056767

Names & identifiers

Preferred name: 1-(2-Chlorophenyl)sulfonyl-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea;methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate
IUPAC: 1-(2-chlorophenyl)sulfonyl-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea;methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate

Names & synonyms

108823-51-4DTXSID60910878N'-(2-Chlorobenzene-1-sulfonyl)-N-(6-methoxy-4-methyl-1,3,5-triazin-2(1H)-ylidene)carbamimidic acid--methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate (1/1)Propanoic acid, 2-(4-(2,4-dichlorophenoxy)phenoxy)-, methyl ester, mixt. with 2-chloro-N-(((4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino)carbonyl)benzenesulfonamide

Database identifiers

CAS: 108823-51-4
PubChem CID: 184012
DTXSID: DTXSID60910878

Properties

Computed structural properties

Topological polar surface area: 176 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 11
Rotatable bonds: 10
Heavy atoms: 45
Formal charge: 0
Complexity: 872

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