3-Methyl-1,3-thiazolidine-2,4-dione

C4H5NO2SCAS 16312-21-3131.15 g/mol

Open in Covalent MOL file
NOSO
AmideLactamSulfide

Properties

Molecular formula
C4H5NO2S
Molar mass
131.15 g/mol
Exact mass
131.0041 Da
logP
0.31Crippen estimate
Polar surface area
37.4 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
16312-21-3
SMILES
CN1C(=O)CSC1=O
InChIKey
HMLWNNMYODLLJO-UHFFFAOYSA-N
InChI
InChI=1S/C4H5NO2S/c1-5-3(6)2-8-4(5)7/h2H2,1H3

Weigh it out

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Names and synonyms

1 names
  • 3-Methyl-1,3-thiazolane-2,4-dione

Work with 3-Methyl-1,3-thiazolidine-2,4-dione

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

N-Methylsuccinimide1121-07-944 % similar Dimethylbarbituric acid769-42-639 % similar 3-Ethylrhodanine7648-01-335 % similar 3-Aminorhodanine1438-16-033 % similar Sarcosine anhydride5076-82-433 % similar Mecarbam2595-54-232 % similar Triallate2303-17-532 % similar 2-Chloro-N,N-dimethylacetamide2675-89-031 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Ethoxycarbonyl isothiocyanate16182-04-0 Methyl 2-isothiocyanatoacetate21055-37-8 4H-1,4-Thiazine 1,1-dioxide40263-61-4 2-[(Cyanomethyl)sulfanyl]acetic acid55817-29-3

Elsewhere

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