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A1H0M

Summary
Name:6-bromanyl-1,3-benzothiazol-2-amine
Formula:C7 H5 Br N2 S
Formal charge:0
Formula weight:229.097 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.76-bromanyl-1,3-benzothiazol-2-amine

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C7H5BrN2S/c8-4-1-2-5-6(3-4)11-7(9)10-5/h1-3H,(H2,9,10)
InChIKeyInChI1.06VZEBSJIOUMDNLY-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Nc1sc2cc(Br)ccc2n1
SMILESCACTVS3.385Nc1sc2cc(Br)ccc2n1
SMILES_CANONICALOpenEye OEToolkits2.0.7c1cc2c(cc1Br)sc(n2)N
SMILESOpenEye OEToolkits2.0.7c1cc2c(cc1Br)sc(n2)N

221371

PDB entries from 2024-06-19

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