Z07

4-(trifluoromethyl)-1,3-benzothiazol-2-amine

Created: 2021-04-07
Last modified:  2022-03-16

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Chemical Details

Formal Charge0
Atom Count19
Chiral Atom Count0
Bond Count20
Aromatic Bond Count10
2D diagram of Z07

Chemical Component Summary

Name4-(trifluoromethyl)-1,3-benzothiazol-2-amine
Systematic Name (OpenEye OEToolkits)4-(trifluoromethyl)-1,3-benzothiazol-2-amine
FormulaC8 H5 F3 N2 S
Molecular Weight218.199
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01FC(F)(F)c1cccc2sc(N)nc12
SMILESCACTVS3.385Nc1sc2cccc(c2n1)C(F)(F)F
SMILESOpenEye OEToolkits2.0.7c1cc(c2c(c1)sc(n2)N)C(F)(F)F
Canonical SMILESCACTVS3.385 Nc1sc2cccc(c2n1)C(F)(F)F
Canonical SMILESOpenEye OEToolkits2.0.7 c1cc(c2c(c1)sc(n2)N)C(F)(F)F
InChIInChI1.03 InChI=1S/C8H5F3N2S/c9-8(10,11)4-2-1-3-5-6(4)13-7(12)14-5/h1-3H,(H2,12,13)
InChIKeyInChI1.03 FGZBTCDIPNGYRC-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 108937