chempirical

2-(4-Morpholinothio)benzothiazole

C11H12N2OS2CAS 102-77-2252.35 g/mol

Open in Covalent MOL file
SSNON
EtherTertiary amine

Properties

Molecular formula
C11H12N2OS2
Molar mass
252.35 g/mol
Exact mass
252.0391 Da
Density
1.34 g/mL (at 25 °C)
Melting point
80 °C
logP
2.64Crippen estimate
Polar surface area
25.4 Ų
H-bond donors / acceptors
0 / 5
Rotatable bonds
2

Identifiers

CAS number
102-77-2
SMILES
c1ccc2sc(SN3CCOCC3)nc2c1
InChIKey
MHKLKWCYGIBEQF-UHFFFAOYSA-N
InChI
InChI=1S/C11H12N2OS2/c1-2-4-10-9(3-1)12-11(15-10)16-13-5-7-14-8-6-13/h1-4H,5-8H2

Weigh it out

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

Names and synonyms

45 names · show all
  • Benzothiazole, 2-(4-morpholinylthio)-
  • Benzothiazole, 2-(morpholinothio)-
  • Morpholine, 4-(2-benzothiazolylthio)-
  • 2-(4-Morpholinylthio)benzothiazole
  • Sulfenamide M
  • Amax
  • Santocure MOR
  • Vulcafor BSM
  • 2-Benzothiazolyl N-morpholino sulfide
  • 4-(2-Benzothiazolylthio)morpholine
  • N,N-(Oxydiethylene)benzothiazole-2-sulfenamide
  • 2-(Morpholinothio)benzothiazole
  • Vulkacit MOZ
  • 2-Benzothiazolesulfenemorpholide
  • 2-Benzothiazolylsulfenylmorpholine
  • NOBS Special
  • 2-(4-Morpholinylmercapto)benzothiazole
  • Sulfenax MOR
  • Nocceler MSA
  • Vulcafor MBS
  • N-Oxydiethylene-2-benzothiazolylsulfenamide
  • Meramid M
  • Soxinol NBS
  • Delac MOR
  • Vulkacit MOZ/LG
  • MBS
  • Sanceler NOB
  • Nocceler MSA-G
  • N-Morpholino-2-benzothiazolylsulfenamide
  • SA-M
  • N-Oxydiethyl-2-benzothiazolesulfenamide
  • OBTS
  • Cure-rite OBTS
  • 2-Benzothiazolesulfenic acid morpholide
  • Accel NS
  • Rhenogran MBS 80
  • NSC 70078
  • Santocure MBS
  • Pilcure MOR
  • Accelerator NS
  • NS
  • NOBS
  • MBS 80
  • N-(Oxidiethylene)-2-benzothiazolyl sulfenamide
  • 2-(Morpholin-4-ylsulfanyl)-1,3-benzothiazole

Work with 2-(4-Morpholinothio)benzothiazole

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-(4-Morpholinodithio)benzothiazole95-32-974 % similar Accelerator dm120-78-553 % similar N,N-Dicyclohexyl-2-benzothiazolesulfenamide4979-32-252 % similar 2-(Methylthio)benzothiazole615-22-549 % similar Tcmtb21564-17-047 % similar 2-(2-Benzothiazolylthio)acetic acid6295-57-443 % similar Accelerator cz95-33-043 % similar N-(1,1-Dimethylethyl)-2-benzothiazolesulfenamide95-31-842 % similar

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

Elsewhere

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