chempirical

(Αz)-2-amino-α-(methoxyimino)-4-thiazoleacetic acid

C6H7N3O3SCAS 65872-41-5201.20 g/mol

Open in Covalent MOL file
ONOOHSNHHN
Carboxylic acidOxime

Properties

Molecular formula
C6H7N3O3S
Molar mass
201.20 g/mol
Exact mass
201.0208 Da
logP
-0.01Crippen estimate
Polar surface area
98.5 Ų
H-bond donors / acceptors
3 / 5
Rotatable bonds
3

Identifiers

CAS number
65872-41-5
SMILES
CO/N=C(C(=O)O)c1csc(=N)[nH]1
InChIKey
NLARCUDOUOQRPB-WTKPLQERSA-N
InChI
InChI=1S/C6H7N3O3S/c1-12-9-4(5(10)11)3-2-13-6(7)8-3/h2H,1H3,(H2,7,8)(H,10,11)/b9-4-

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Type any one amount. The others follow from the molar mass.

Names and synonyms

13 names · show all
  • (Z)-2-Amino-α-(methoxyimino)-4-thiazoleacetic acid
  • 4-Thiazoleacetic acid, 2-amino-α-(methoxyimino)-, (αZ)-
  • 4-Thiazoleacetic acid, 2-amino-α-(methoxyimino)-, (Z)-
  • Thiazoximic acid
  • 2-(2-Amino-4-thiazolyl)-(Z)-2-methoxyiminoacetic acid
  • syn-2-(2-Aminothiazol-4-yl)-2-methoxyiminoacetic acid
  • 2-(2-Aminothiazol-4-yl)-2-(Z)-methoxyiminoacetic acid
  • 2-(2-Aminothiazole-4-yl)-2-(Z)-methoxyiminoacetic acid
  • (Z)-2-(2-Aminothiazol-4-yl)-2-methoxyiminoacetic acid
  • (Z)-(2-Aminothiazol-4-yl)-α-(methoxyimino)acetic acid
  • syn-Thiazoximic acid
  • (Z)-(2-Aminothiazol-4-yl)methoxyiminoacetic acid
  • Ansaiwosuan

Work with (Αz)-2-amino-α-(methoxyimino)-4-thiazoleacetic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Ethyl (αz)-2-amino-α-(methoxyimino)-4-thiazoleacetate64485-88-763 % similar (Αz)-2-amino-α-[[2-(1,1-dimethylethoxy)-1,1-dimethyl-2-oxoethoxy]imino]-4-thiazoleacetic acid86299-47-060 % similar 2-Amino-α-oxo-4-thiazoleacetic acid73150-67-156 % similar Ceftizoxime68401-81-055 % similar Cefetamet65052-63-354 % similar Cefpodoxime80210-62-451 % similar 2-Amino-α-(methoxyimino)-4-thiazoleethanethioic acid S-2-benzothiazolyl ester80756-85-049 % similar (Αz)-5-amino-α-(methoxyimino)-1,2,4-thiadiazole-3-acetic acid72217-12-049 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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