chempirical

Cymiazole

C12H14N2SCAS 61676-87-7218.32 g/mol

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NSN

Properties

Molecular formula
C12H14N2S
Molar mass
218.32 g/mol
Exact mass
218.0878 Da
Melting point
44 °C
logP
2.94Crippen estimate
Polar surface area
17.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 39 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P301+P317, P330, P501

Identifiers

CAS number
61676-87-7
SMILES
Cc1ccc(N=c2sccn2C)c(C)c1
InChIKey
YUAUPYJCVKNAEC-UHFFFAOYSA-N
InChI
InChI=1S/C12H14N2S/c1-9-4-5-11(10(2)8-9)13-12-14(3)6-7-15-12/h4-8H,1-3H3

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Names and synonyms

8 names
  • Benzenamine, 2,4-dimethyl-N-(3-methyl-2(3H)-thiazolylidene)-
  • 2,4-Dimethyl-N-(3-methyl-2(3H)-thiazolylidene)benzenamine
  • CGA 50439
  • Tifatol
  • Xymiazole
  • Besuntol
  • 2-(2′,4′-Dimethylphenylimino)-3-methylthiazoline
  • 2,4-Dimethyl-N-(3-methylthiazol-2(3H)-ylidene)aniline

Work with Cymiazole

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

1-Isothiocyanato-2,4-dimethylbenzene39842-01-840 % similar Amitraz33089-61-139 % similar 1,2,4-Trimethylbenzene95-63-636 % similar 3,5-Dimethylthianaphthene1964-45-036 % similar 2,4-Dimethylbenzaldehyde15764-16-633 % similar 1-Iodo-2,4-dimethylbenzene4214-28-233 % similar Chloro-p-xylene95-72-733 % similar N-(2,4-Dimethylphenyl)-3-oxobutanamide97-36-933 % similar

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

Elsewhere

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