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FBB

Summary
Name:6-fluoro-1,3-benzothiazol-2-amine
Formula:C7 H5 F N2 S
Formal charge:0
Formula weight:168.191 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.016-fluoro-1,3-benzothiazol-2-amine
OpenEye OEToolkits1.7.66-fluoranyl-1,3-benzothiazol-2-amine

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01Fc1ccc2nc(sc2c1)N
InChIInChI1.03InChI=1S/C7H5FN2S/c8-4-1-2-5-6(3-4)11-7(9)10-5/h1-3H,(H2,9,10)
InChIKeyInChI1.03CJLUXPZQUXVJNF-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.370Nc1sc2cc(F)ccc2n1
SMILESCACTVS3.370Nc1sc2cc(F)ccc2n1
SMILES_CANONICALOpenEye OEToolkits1.7.6c1cc2c(cc1F)sc(n2)N
SMILESOpenEye OEToolkits1.7.6c1cc2c(cc1F)sc(n2)N

221371

PDB entries from 2024-06-19

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