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2-Carboxymethoxyimino-2-(5-amino-1,2,4-thiadiazol-3-yl)acetic acid

HCID 54080689
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Nc1nc(C(=NOCC(=O)O)C(=O)O)ns1
InChIKey
MMWUUQAJVKBBGJ-UHFFFAOYSA-N
Molecular formula
C6H6N4O5S
Average molar mass
246.2 g/mol

Names & identifiers

Preferred name
2-Carboxymethoxyimino-2-(5-amino-1,2,4-thiadiazol-3-yl)acetic acid
IUPAC
2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(carboxymethoxyimino)acetic acid

Names & synonyms

SCHEMBL9523138MMWUUQAJVKBBGJ-UHFFFAOYSA-N2-carboxymethoxyimino-2-(5-amino-1,2,4-thiadiazol-3-yl)acetic acid

Database identifiers

PubChem CID
54080689

Properties

Computed structural properties

XLogP
0.3
Topological polar surface area
176 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
10
Rotatable bonds
5
Heavy atoms
16
Formal charge
0
Complexity
322

Related reactions

1 records
New reaction record
HRID 2412859 reaction equation
HRID 2412859As reactantuspto-grants-1985_01

Compound notes

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