chempirical

2-Amino-5-mercapto-1,3,4-thiadiazole

C2H3N3S2CAS 2349-67-9133.19 g/mol

Open in Covalent MOL file
HNHNNSHS
Thiol

Properties

Molecular formula
C2H3N3S2
Molar mass
133.19 g/mol
Exact mass
132.9768 Da
Melting point
235 °C
logP
0.24Crippen estimate
Polar surface area
52.5 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
0

Identifiers

CAS number
2349-67-9
SMILES
N=c1[nH]nc(S)s1
InChIKey
GDGIVSREGUOIJZ-UHFFFAOYSA-N
InChI
InChI=1S/C2H3N3S2/c3-1-4-5-2(6)7-1/h(H2,3,4)(H,5,6)

Weigh it out

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

Names and synonyms

28 names · show all
  • 1,3,4-Thiadiazole-2(3H)-thione, 5-amino-
  • 1,3,4-Thiadiazole-2-thiol, 5-amino-
  • δ2-1,3,4-Thiadiazoline-2-thiol, 5-imino-
  • 5-Amino-1,3,4-thiadiazole-2(3H)-thione
  • 2-Mercapto-5-amino-1,3,4-thiadiazole
  • 5-Amino-1,3,4-thiadiazole-2-thiol
  • 2-Thiol-5-amino-1,3,4-thiadiazole
  • 2-Amino-δ2-1,3,4-thiadiazoline-5-thione
  • 2-Amino-1,3,4-thiadiazole-5-thiol
  • 5-Amino-1,3,4-thiadiazoline-2-thione
  • 5-Amino-2-mercapto-1,3,4-thiadiazole
  • 2-Amino-1,3,4-thiadiazol-5-thiol
  • 2-Amino-1,3,4-thiadiazole-5-mercaptan
  • WR 180
  • 5-Amino-3H-1,3,4-thiadiazole-2-thione
  • 2-Amino-5-mercaptothiadiazole
  • ATT
  • NSC 209061
  • NSC 21402
  • 5-Amino-1,3,4-thiadiazole-2-thione
  • 5-Thio-2-amino-[1,3,4]thiadiazole
  • 5-Amino-1,3,4-thidiazole-2-thiol
  • 5-Thiol-2-amino-1,3,4-thiadiazole
  • 2-Mercapto-5-aminothiadiazole
  • 5-Amino-1,3,4-thiadiazole-5-thiol
  • 2-Amino-5-sulfhydryl-1,3,4-thiadiazole
  • 5-Amino-2-sulfhydryl-1,3,4-thiadiazole
  • 2-Amino-5-sulfanyl-1,3,4-thiadiazole

Work with 2-Amino-5-mercapto-1,3,4-thiadiazole

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

2-Amino-5-methyl-1,3,4-thiadiazole108-33-848 % similar 5-(Trifluoromethyl)-1,3,4-thiadiazol-2-amine10444-89-043 % similar 2-Amino-5-ethyl-1,3,4-thiadiazole14068-53-243 % similar 5-(1,1-Dimethylethyl)-1,3,4-thiadiazol-2-amine39222-73-643 % similar 5-(Methylthio)-1,3,4-thiadiazol-2-amine5319-77-743 % similar 5-(Ethylthio)-1,3,4-thiadiazol-2-amine25660-70-239 % similar 5-[(Phenylmethyl)thio]-1,3,4-thiadiazol-2-amine25660-71-334 % similar 2,5-Dimercapto-1,3,4-thiadiazole1072-71-533 % similar

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

Elsewhere

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