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GO2

Summary
Name:1-(1,3-benzothiazol-2-yl)guanidine
Formula:C8 H8 N4 S
Formal charge:0
Formula weight:192.241 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.61-(1,3-benzothiazol-2-yl)guanidine

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C8H8N4S/c9-7(10)12-8-11-5-3-1-2-4-6(5)13-8/h1-4H,(H4,9,10,11,12)
InChIKeyInChI1.03QMHWARSFUCGBJK-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385NC(=N)Nc1sc2ccccc2n1
SMILESCACTVS3.385NC(=N)Nc1sc2ccccc2n1
SMILES_CANONICALOpenEye OEToolkits2.0.6[H]/N=C(/N)\Nc1nc2ccccc2s1
SMILESOpenEye OEToolkits2.0.6c1ccc2c(c1)nc(s2)NC(=N)N

219140

PDB entries from 2024-05-01

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