chempirical

Methylthiouracil

C5H6N2OSCAS 56-04-2142.18 g/mol

Open in Covalent MOL file
OHNHSN
PhenolThiol

Properties

Molecular formula
C5H6N2OS
Molar mass
142.18 g/mol
Exact mass
142.0201 Da
Density
1.5 g/mL
Melting point
330 °C (decomposes)
logP
0.78Crippen estimate
Polar surface area
46.0 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
0

Identifiers

CAS number
56-04-2
SMILES
Cc1cc(O)nc(S)n1
InChIKey
HWGBHCRJGXAGEU-UHFFFAOYSA-N
InChI
InChI=1S/C5H6N2OS/c1-3-2-4(8)7-5(9)6-3/h2H,1H3,(H2,6,7,8,9)

Weigh it out

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

Names and synonyms

51 names · show all
  • 4(1H)-Pyrimidinone, 2,3-dihydro-6-methyl-2-thioxo-
  • Uracil, 6-methyl-2-thio-
  • 2,3-Dihydro-6-methyl-2-thioxo-4(1H)-pyrimidinone
  • Alkiron
  • Antibason
  • Basecil
  • 2-Mercapto-6-methylpyrimidin-4-one
  • Metacil
  • Methiacil
  • Methicil
  • Methiocil
  • 6-Methyl-2-thio-2,4-(1H,3H)-pyrimidinedione
  • 6-Methyl-2-thiouracil
  • MTU
  • Muracil
  • Prostrumyl
  • Strumacil
  • Thimecil
  • 6-Thio-4-methyluracil
  • Methacil
  • 2-Mercapto-4-methyl-6-hydroxypyrimidine
  • 6-Methyl-2-mercaptouracil
  • 2-Mercapto-6-methylpyrimidyl-4-one
  • 6-Methyl-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidine
  • 4-Methyl-2-thiouracil
  • 2-Thio-6-methyluracil
  • Thyreonorm
  • 4-Hydroxy-2-mercapto-6-methylpyrimidine
  • Tiorale M
  • Thiothymin
  • Orcanon
  • Tiomeracil
  • 2-Mercapto-6-methyl-4-pyrimidinol
  • 4-Hydroxy-6-methyl-2-mercaptopyrimidine
  • Metiur
  • Tiotiron
  • Muracin
  • Thiothyron
  • Thiomecil
  • NSC 193526
  • Basethyrin
  • Thiuryl
  • USAF-EK 6454
  • Thiomidil
  • NSC 9378
  • Thioryl
  • Thyril
  • NSC 314271
  • 4-Hydroxy-6-methylpyrimidine-2(1H)-thione
  • 6-Methyl-2-thioxopyrimidin-4-one
  • 2-Mercapto-6-methylpyrimidin-4(3H)-one

Work with Methylthiouracil

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

4,6-Dimethyl-2-mercaptopyrimidine22325-27-567 % similar 2,6-Dimethyl-4(3H)-pyrimidinone6622-92-057 % similar 6-Amino-2-thiouracil1004-40-653 % similar 4-Hydroxy-6-methyl-2(1H)-pyridinone3749-51-752 % similar 2-Isopropyl-6-methyl-4-pyrimidinol2814-20-250 % similar Propylthiouracil51-52-550 % similar 2,3-Dihydro-2-thioxo-6-(trifluoromethyl)-4(1H)-pyrimidinone368-54-748 % similar 6-Phenyl-2-thiouracil36822-11-447 % similar

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

Same formula

2-Amino-3-thiophenecarboxamide14080-51-4 3-Aminothiophene-2-carboxamide147123-47-5 Thiophene-2-carbohydrazide2361-27-5 N-2-Thiazolylacetamide2719-23-5 2-(Methylthio)-4(3H)-pyrimidinone5751-20-2 2-Thiothymine636-26-0

Elsewhere

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