chempirical

Ametryn

C9H17N5SCAS 834-12-8227.33 g/mol

Open in Covalent MOL file
NNSNHNHN
Sulfide

Properties

Molecular formula
C9H17N5S
Molar mass
227.33 g/mol
Exact mass
227.1205 Da
Density
1.19 g/mL (at 20 °C)
Melting point
88–89 °C
Boiling point
345 °C
logP
0.69Crippen estimate
Polar surface area
69.2 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
3

Identifiers

CAS number
834-12-8
SMILES
CCN=c1nc(SC)[nH]c(=NC(C)C)[nH]1
InChIKey
RQVYBGPQFYCBGX-UHFFFAOYSA-N
InChI
InChI=1S/C9H17N5S/c1-5-10-7-12-8(11-6(2)3)14-9(13-7)15-4/h6H,5H2,1-4H3,(H2,10,11,12,13,14)

Weigh it out

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

Names and synonyms

25 names · show all
  • 1,3,5-Triazine-2,4-diamine, N2-ethyl-N4-(1-methylethyl)-6-(methylthio)-
  • s-Triazine, 2-(ethylamino)-4-(isopropylamino)-6-(methylthio)-
  • 1,3,5-Triazine-2,4-diamine, N-ethyl-N′-(1-methylethyl)-6-(methylthio)-
  • N2-Ethyl-N4-(1-methylethyl)-6-(methylthio)-1,3,5-triazine-2,4-diamine
  • A 1093
  • G 34162
  • Ametryne
  • 2-Ethylamino-4-isopropylamino-6-methylmercapto-s-triazine
  • 2-Ethylamino-4-isopropylamino-6-methylthio-s-triazine
  • 2-Methylmercapto-4-ethylamino-6-isopropylamino-s-triazine
  • 2-Methylthio-4-ethylamino-6-isopropylamino-s-triazine
  • Gesapax
  • Evik
  • 2-Ethylamino-4-isopropylamino-6-methylthio-1,3,5-triazine
  • Cemerin
  • Primatol Z 80
  • 2-Ethylamino-4-methylthio-6-isopropylamino-1,3,5-triazine
  • 2-Methylthio-4-ethylamino-6-isopropylamino-sym-triazine
  • Ametrex
  • NSC 163044
  • Doruplant
  • Amephyt
  • N-Ethyl-N′-(1-methylethyl)-6-(methylthio)-1,3,5-triazine-2,4-diamine
  • Metrimex 500SC
  • 2-N-Ethyl-6-(methylsulfanyl)-4-N-(propan-2-yl)-1,3,5-triazine-2,4-diamine

Work with Ametryn

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

Simetryn1014-70-673 % similar Prometryn7287-19-673 % similar Atrazine1912-24-963 % similar Simazine122-34-942 % similar Propazine139-40-242 % similar Terbutryn886-50-039 % similar Simeton673-04-139 % similar Irgarol28159-98-031 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook