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

HCID 54519409
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Basic information

Standard SMILES
CC(C)(C)OC(=O)CON=C(C(=O)O)c1nsc(N)n1
InChIKey
YOSFGDLBDAFZMZ-UHFFFAOYSA-N
Molecular formula
C10H14N4O5S
Average molar mass
302.31 g/mol

Names & identifiers

Preferred name
2-Tert-butoxycarbonylmethoxyimino-2-(5-amino-1,2,4-thiadiazol-3-yl)acetic acid
IUPAC
2-(5-amino-1,2,4-thiadiazol-3-yl)-2-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]iminoacetic acid

Names & synonyms

SCHEMBL9482040YOSFGDLBDAFZMZ-UHFFFAOYSA-N2-tert-butoxycarbonylmethoxyimino-2-(5-amino-1,2,4-thiadiazol-3-yl)acetic acid

Database identifiers

PubChem CID
54519409

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
165 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
10
Rotatable bonds
7
Heavy atoms
20
Formal charge
0
Complexity
409

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Related reactions

4 records
New reaction record
HRID 358079 reaction equation
HRID 358079As reactantuspto-grants-1984_08
HRID 663387 reaction equation
HRID 663387As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 1284654 reaction equation
HRID 1284654As reactantuspto-grants-1986_01
HRID 1995794 reaction equation
HRID 1995794As reactantuspto-grants-1983_09

Compound notes

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