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IAW

Summary
Name:6-methoxy-[1,2,4]triazolo[3,4-b][1,3]benzothiazole
Formula:C9 H7 N3 O S
Formal charge:0
Formula weight:205.236 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.76-methoxy-[1,2,4]triazolo[3,4-b][1,3]benzothiazole

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C9H7N3OS/c1-13-6-2-3-7-8(4-6)14-9-11-10-5-12(7)9/h2-5H,1H3
InChIKeyInChI1.06VBZWNZIFSFRMTM-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385COc1ccc2n3cnnc3sc2c1
SMILESCACTVS3.385COc1ccc2n3cnnc3sc2c1
SMILES_CANONICALOpenEye OEToolkits2.0.7COc1ccc2c(c1)sc3n2cnn3
SMILESOpenEye OEToolkits2.0.7COc1ccc2c(c1)sc3n2cnn3

222415

PDB entries from 2024-07-10

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