chempirical

Thiocarbanilide

C13H12N2SCAS 102-08-9228.31 g/mol

Open in Covalent MOL file
SHNNH
Thiol

Properties

Molecular formula
C13H12N2S
Molar mass
228.31 g/mol
Exact mass
228.0721 Da
Density
1.32 g/mL
Melting point
154 °C
logP
3.72Crippen estimate
Polar surface area
24.4 Ų
H-bond donors / acceptors
2 / 1
Rotatable bonds
2

Identifiers

CAS number
102-08-9
SMILES
SC(=Nc1ccccc1)Nc1ccccc1
InChIKey
FCSHMCFRCYZTRQ-UHFFFAOYSA-N
InChI
InChI=1S/C13H12N2S/c16-13(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h1-10H,(H2,14,15,16)

Weigh it out

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

Names and synonyms

22 names · show all
  • Thiourea, N,N′-diphenyl-
  • Carbanilide, thio-
  • N,N′-Diphenylthiourea
  • s-Diphenylthiocarbamide
  • Sym-Diphenylthiourea
  • 1,3-Diphenyl-2-thiourea
  • Sulfocarbanilide
  • N,N′-Diphenylthiocarbamide
  • 1,3-Diphenylthiourea
  • Diphenylthiourea
  • Stabilisator C
  • Vulkacit CA
  • Rhenocure CA
  • Nocceler C
  • NSC 28134
  • NSC 686
  • Accelerant CA
  • 1,3-Bis(phenyl)thiourea
  • CA
  • Accelerator CA
  • CA 50
  • Accelerator C

Work with Thiocarbanilide

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-Methyl-N′-phenylthiourea2724-69-860 % similar 4-Phenylthiosemicarbazide5351-69-960 % similar 1,3-Diphenylurea102-07-857 % similar 1-Phenyl-3-(2-thiazolyl)-2-thiourea14901-16-754 % similar Phenylthiocarbamide103-85-545 % similar N-Phenylethanethioamide637-53-645 % similar 2,2′-Diphenylcarbonothioic dihydrazide622-03-743 % similar N,N′-Bis(2-methylphenyl)thiourea137-97-342 % similar

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

Same formula

4-Isothiocyanato-N,N-dimethyl-1-naphthalenamine29711-79-3

Elsewhere

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