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82I

Summary
Name:4-chloranyl-2-methyl-5-(methylamino)pyridazin-3-one
Formula:C6 H8 Cl N3 O
Formal charge:0
Formula weight:173.6 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.64-chloranyl-2-methyl-5-(methylamino)pyridazin-3-one

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C6H8ClN3O/c1-8-4-3-9-10(2)6(11)5(4)7/h3,8H,1-2H3
InChIKeyInChI1.03ACZYSEPOODWZET-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CNC1=C(Cl)C(=O)N(C)N=C1
SMILESCACTVS3.385CNC1=C(Cl)C(=O)N(C)N=C1
SMILES_CANONICALOpenEye OEToolkits2.0.6CNC1=C(C(=O)N(N=C1)C)Cl
SMILESOpenEye OEToolkits2.0.6CNC1=C(C(=O)N(N=C1)C)Cl

222415

PDB entries from 2024-07-10

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