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ZVO

Summary
Name:5-methyl-1,5-dihydro-1,4,5,6,8-pentaazaacenaphthylen-3-amine
Formula:C8 H8 N6
Formal charge:0
Formula weight:188.189 Da
Component type:NON-POLYMER
Ambiguous Chemistry Warning:The chemical description of this component is not well described in this definition. Descriptors and chemical names should be used with caution.

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C8H8N6/c1-14-8-5-4(6(9)13-14)2-10-7(5)11-3-12-8/h2-3H,1H3,(H2,9,13)(H,10,11,12)
InChIKeyInChI1.03AJJBAXSCYXENBJ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CN1N=C(N)c2c[nH]c3ncnc1c23
SMILESCACTVS3.385CN1N=C(N)c2c[nH]c3ncnc1c23
SMILES_CANONICALOpenEye OEToolkits1.7.6CN1c2c3c(c[nH]c3ncn2)C(=N1)N
SMILESOpenEye OEToolkits1.7.6CN1c2c3c(c[nH]c3ncn2)C(=N1)N

224004

PDB entries from 2024-08-21

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