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F04

Summary
Name:2-ETHYL-4-METHYL-PHTHALAZIN-1-ONE
Formula:C11 H12 N2 O
Formal charge:0
Formula weight:188.226 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits1.6.12-ethyl-4-methyl-phthalazin-1-one

Chemical Descriptors

TypeProgramVersionDescriptor
SMILES_CANONICALCACTVS3.352CCN1N=C(C)c2ccccc2C1=O
SMILESCACTVS3.352CCN1N=C(C)c2ccccc2C1=O
SMILES_CANONICALOpenEye OEToolkits1.6.1CCN1C(=O)c2ccccc2C(=N1)C
SMILESOpenEye OEToolkits1.6.1CCN1C(=O)c2ccccc2C(=N1)C
InChIInChI1.03InChI=1S/C11H12N2O/c1-3-13-11(14)10-7-5-4-6-9(10)8(2)12-13/h4-7H,3H2,1-2H3
InChIKeyInChI1.03ITVFFHLKZDWITI-UHFFFAOYSA-N

226707

PDB entries from 2024-10-30

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