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2-(2-Formamidothiazol-4-yl)-2-(2-methylthiazol-4-ylmethoxyimino)acetic acid

HCID 53718792
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1nc(CON=C(C(=O)O)c2csc(NC=O)n2)cs1
InChIKey
CFUBHROFKFFPSZ-UHFFFAOYSA-N
Molecular formula
C11H10N4O4S2
Average molar mass
326.4 g/mol
Monoisotopic mass
326.01434716

Names & identifiers

Preferred name
2-(2-Formamidothiazol-4-yl)-2-(2-methylthiazol-4-ylmethoxyimino)acetic acid
IUPAC
2-(2-formamido-1,3-thiazol-4-yl)-2-[(2-methyl-1,3-thiazol-4-yl)methoxyimino]acetic acid

Names & synonyms

SCHEMBL10910125CFUBHROFKFFPSZ-UHFFFAOYSA-N2-(2-Formamidothiazol-4-yl)-2-(2-methylthiazol-4-yl-methoxyimino)acetic acid2-(2-formamidothiazol-4-yl)-2-(2-methylthiazol-4-ylmethoxyimino)-acetic acid2-(2-formamidothiazol-4-yl)-2-(2-methylthiazol-4-ylmethoxyimino)acetic acid

Database identifiers

PubChem CID
53718792

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
170 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
9
Rotatable bonds
6
Heavy atoms
21
Formal charge
0
Complexity
423

Related reactions

7 records
New reaction record
HRID 745384 reaction equation
HRID 745384As productuspto-grants-1986_07
HRID 745420 reaction equation
HRID 745420As reactantuspto-grants-1986_07
HRID 894761 reaction equation
HRID 894761As productuspto-grants-1981_08
HRID 894799 reaction equation
HRID 894799As reactantuspto-grants-1981_08
HRID 1758387 reaction equation
HRID 1758387As productuspto-grants-1983_02
HRID 1758426 reaction equation
HRID 1758426As reactantuspto-grants-1983_02
HRID 2156889 reaction equation
HRID 2156889As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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