chempirical

N-4-Pyridinylthiourea

C6H7N3SCAS 164670-44-4153.20 g/mol

Open in Covalent MOL file
NHHSNNH
Thiol

Properties

Molecular formula
C6H7N3S
Molar mass
153.20 g/mol
Exact mass
153.0361 Da
logP
0.78Crippen estimate
Polar surface area
52.0 Ų
H-bond donors / acceptors
3 / 1
Rotatable bonds
0

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
164670-44-4
SMILES
N=C(S)N=c1cc[nH]cc1
InChIKey
HLOFIQOOOSRNFY-UHFFFAOYSA-N
InChI
InChI=1S/C6H7N3S/c7-6(10)9-5-1-3-8-4-2-5/h1-4H,(H3,7,8,9,10)

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Names and synonyms

7 names
  • Thiourea, N-4-pyridinyl-
  • Thiourea, 4-pyridinyl-
  • 1-(4-Pyridyl)thiourea
  • NSC 201960
  • 4-Pyridylthiourea
  • Pyridin-4-ylthiourea
  • N-(4-Pyridyl)thiourea

Work with N-4-Pyridinylthiourea

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-(Pyridin-4-yl)pivalamide70298-89-440 % similar 4-(Methylamino)pyridine1121-58-038 % similar 4-Hydroxypyridine108-96-337 % similar 4-Hydroxypyridine626-64-237 % similar Benzoylthiourea614-23-336 % similar N-Octylpyridin-4-amine64690-19-332 % similar 4-Aminopyridine504-24-532 % similar Y-27632146986-50-730 % similar

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

Same formula

2-Pyridylthiourea14294-11-2 N-3-Pyridinylthiourea30162-37-9

Elsewhere

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