chempirical

2-(Methylthio)-3-ethylpyrazine

C7H10N2SCAS 72987-62-3154.23 g/mol

Open in Covalent MOL file
NNS
Sulfide

Properties

Molecular formula
C7H10N2S
Molar mass
154.23 g/mol
Exact mass
154.0565 Da
logP
1.76Crippen estimate
Polar surface area
25.8 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
2

Identifiers

CAS number
72987-62-3
SMILES
CCc1nccnc1SC
InChIKey
XYHPPOMSLGJAAM-UHFFFAOYSA-N
InChI
InChI=1S/C7H10N2S/c1-3-6-7(10-2)9-5-4-8-6/h4-5H,3H2,1-2H3

Weigh it out

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

Names and synonyms

4 names
  • Pyrazine, 2-ethyl-3-(methylthio)-
  • 2-Ethyl-3-(methylthio)pyrazine
  • 2-Ethyl-3-methylthiopyrazine
  • 2-Ethyl-3-(methylsulfanyl)pyrazine

Work with 2-(Methylthio)-3-ethylpyrazine

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

2,3-Diethylpyrazine15707-24-158 % similar 2-Ethyl-3-methylpyrazine15707-23-048 % similar 2-Methyl-3-(methylthio)pyrazine2882-20-448 % similar 2-Ethyl-3-methoxypyrazine25680-58-444 % similar 2-Acetyl-3-ethylpyrazine32974-92-840 % similar 2-Ethylpyrazine13925-00-334 % similar 2-(Methylthio)pyrazine21948-70-934 % similar 2-Methyl-3-propylpyrazine15986-80-832 % similar

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

Same formula

4,6-Dimethyl-2-(methylthio)pyrimidine14001-64-0 4,5,6,7-Tetrahydro-2-benzothiazolamine2933-29-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook