chempirical

N,N′-Bis(2-methylphenyl)thiourea

C15H16N2SCAS 137-97-3256.37 g/mol

Open in Covalent MOL file
NHSNH
Thiol

Properties

Molecular formula
C15H16N2S
Molar mass
256.37 g/mol
Exact mass
256.1034 Da
Melting point
161 °C
logP
4.33Crippen estimate
Polar surface area
24.4 Ų
H-bond donors / acceptors
2 / 1
Rotatable bonds
2

Identifiers

CAS number
137-97-3
SMILES
Cc1ccccc1N=C(S)Nc1ccccc1C
InChIKey
KWPNNZKRAQDVPZ-UHFFFAOYSA-N
InChI
InChI=1S/C15H16N2S/c1-11-7-3-5-9-13(11)16-15(18)17-14-10-6-4-8-12(14)2/h3-10H,1-2H3,(H2,16,17,18)

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

Names and synonyms

11 names
  • Thiourea, N,N′-bis(2-methylphenyl)-
  • Carbanilide, 2,2′-dimethylthio-
  • Di-o-tolylthiourea
  • Sym-Di-o-tolylthiourea
  • N,N′-Di-o-tolylthiourea
  • 1,3-Di-o-tolylthiourea
  • 1,3-Bis(o-tolyl)thiourea
  • NSC 119321
  • NSC 37140
  • 1,3-Bis(2-methylphenyl)thiourea
  • Accelerator DOTU

Work with N,N′-Bis(2-methylphenyl)thiourea

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-(2-Methylphenyl)hydrazinecarbothioamide614-10-864 % similar O-Tolylthiourea614-78-851 % similar N-(2-Methylphenyl)urea614-77-747 % similar Di-O-tolylguanidine97-39-247 % similar N-(2-Methylphenyl)acetamide120-66-146 % similar Thiocarbanilide102-08-942 % similar N-(2,6-Dimethylphenyl)hydrazinecarbothioamide71058-35-041 % similar O-Acetoacetotoluidide93-68-541 % similar

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

Same formula

N,N′-Bis(4-methylphenyl)thiourea621-01-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook