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93K

Summary
Name:3,4-bis(azanyl)benzamide
Formula:C7 H9 N3 O
Formal charge:0
Formula weight:151.166 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.63,4-bis(azanyl)benzamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C7H9N3O/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3H,8-9H2,(H2,10,11)
InChIKeyInChI1.03RGJXMMUQTCONEI-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385NC(=O)c1ccc(N)c(N)c1
SMILESCACTVS3.385NC(=O)c1ccc(N)c(N)c1
SMILES_CANONICALOpenEye OEToolkits2.0.6c1cc(c(cc1C(=O)N)N)N
SMILESOpenEye OEToolkits2.0.6c1cc(c(cc1C(=O)N)N)N

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PDB entries from 2024-04-24

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