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UDY

Summary
Name:6-fluoranyl-~{N}-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-benzothiazol-2-amine
Formula:C15 H9 F N4 S2
Formal charge:0
Formula weight:328.387 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.66-fluoranyl-~{N}-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-benzothiazol-2-amine

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C15H9FN4S2/c16-9-4-5-11-13(7-9)22-15(18-11)20-14-19-12(8-21-14)10-3-1-2-6-17-10/h1-8H,(H,18,19,20)
InChIKeyInChI1.03CKLUPEBKNDQOFT-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Fc1ccc2nc(Nc3scc(n3)c4ccccn4)sc2c1
SMILESCACTVS3.385Fc1ccc2nc(Nc3scc(n3)c4ccccn4)sc2c1
SMILES_CANONICALOpenEye OEToolkits2.0.6c1ccnc(c1)c2csc(n2)Nc3nc4ccc(cc4s3)F
SMILESOpenEye OEToolkits2.0.6c1ccnc(c1)c2csc(n2)Nc3nc4ccc(cc4s3)F

223532

数据于2024-08-07公开中

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