chempirical

2-(Methylthio)thiazole

C4H5NS2CAS 5053-24-7131.21 g/mol

Open in Covalent MOL file
SNS
Sulfide

Properties

Molecular formula
C4H5NS2
Molar mass
131.21 g/mol
Exact mass
130.9863 Da
logP
1.86Crippen estimate
Polar surface area
12.9 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
5053-24-7
SMILES
CSC1=NC=CS1
InChIKey
VQNOAXZUEKPSJC-UHFFFAOYSA-N
InChI
InChI=1S/C4H5NS2/c1-6-4-5-2-3-7-4/h2-3H,1H3

Weigh it out

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

Work with 2-(Methylthio)thiazole

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

2-Methylthiazole3581-87-144 % similar 2-Chlorothiazole3034-52-438 % similar 2-Methoxythiazole14542-13-338 % similar 2-(Trimethylsilyl)thiazole79265-30-838 % similar 2-Bromothiazole3034-53-537 % similar 2-Mercaptothiazole5685-05-237 % similar 2-Mercaptothiazole82358-09-637 % similar N-2-Thiazolylacetamide2719-23-536 % similar

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

Same formula

4-Methyl-2(3H)-thiazolethione4498-39-9

Elsewhere

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