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(1Z)-N'-{[(2-bromo-4-methylphenoxy)acetyl]oxy}-2-(thiophen-2-yl)ethanimidamide

HCID 9586325
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Basic information

CAS
424818-36-0
Standard SMILES
Cc1ccc(OCC(=O)O/N=C(\N)Cc2cccs2)c(Br)c1
InChIKey
GMVPUFPJJUZMFX-UHFFFAOYSA-N
Molecular formula
C15H15BrN2O3S
Average molar mass
383.3 g/mol
Monoisotopic mass
381.99868

Names & identifiers

Preferred name
(1Z)-N'-{[(2-bromo-4-methylphenoxy)acetyl]oxy}-2-(thiophen-2-yl)ethanimidamide
IUPAC
[(Z)-(1-amino-2-thiophen-2-ylethylidene)amino] 2-(2-bromo-4-methylphenoxy)acetate

Names & synonyms

424818-36-0[1-Imino-2-(2-thienyl)ethyl]azanyl 2-(2-bromo-4-methylphenoxy)acetateSCHEMBL23094244DTXSID501157821STK183306AKOS001653883(1Z)-N'-{[(2-bromo-4-methylphenoxy)acetyl]oxy}-2-(thiophen-2-yl)ethanimidamideN'-{[(2-bromo-4-methylphenoxy)acetyl]oxy}-2-(2-thienyl)ethanimidamideN-{[(2-Bromo-4-methylphenoxy)acetyl]oxy}(thiophen-2-yl)ethanimidamide(Z)-N'-(2-(2-bromo-4-methylphenoxy)acetoxy)-2-(thiophen-2-yl)acetimidamide[(Z)-(1-amino-2-thiophen-2-ylethylidene)amino] 2-(2-bromo-4-methylphenoxy)acetate

Database identifiers

CAS
424818-36-0
PubChem CID
9586325
DTXSID
DTXSID501157821

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
102 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
7
Heavy atoms
22
Formal charge
0
Complexity
408

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