chempirical

Tricyclazole

C9H7N3SCAS 41814-78-2189.24 g/mol

Open in Covalent MOL file
SNNN

Properties

Molecular formula
C9H7N3S
Molar mass
189.24 g/mol
Exact mass
189.0361 Da
Melting point
187 °C
Boiling point
275 °C
logP
2.25Crippen estimate
Polar surface area
30.2 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
0

Identifiers

CAS number
41814-78-2
SMILES
Cc1cccc2sc3nncn3c12
InChIKey
DQJCHOQLCLEDLL-UHFFFAOYSA-N
InChI
InChI=1S/C9H7N3S/c1-6-3-2-4-7-8(6)12-5-10-11-9(12)13-7/h2-5H,1H3

Weigh it out

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

Names and synonyms

11 names
  • 1,2,4-Triazolo[3,4-b]benzothiazole, 5-methyl-
  • 5-Methyl-1,2,4-triazolo[3,4-b]benzothiazole
  • EL 291
  • Beam
  • Elanco 291
  • MTB
  • Sivic
  • Dhanteam
  • Baan
  • Gain (pesticide)
  • Gain

Work with Tricyclazole

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Chloro-4-methylbenzothiazole3622-32-037 % similar 2-Hydrazino-4-methylbenzothiazole20174-68-934 % similar 2-Amino-4-methylbenzothiazole1477-42-533 % similar 4,6-Dimethyldibenzothiophene1207-12-132 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook