6-(3-imidazol-1-ylpropylamino)-2H-1,2,4-triazine-3,5-dione

Systemtic Name: 6-(3-imidazol-1-ylpropylamino)-2H-1,2,4-triazine-3,5-dione Openeye Name: 6-(3-imidazol-1-ylpropylamino)-2H-1,2,4-triazine-3,5-dione CAS Name: 6-[3-(1-imidazolyl)propylamino]-2H-1,2,4-triazine-3,5-dione IUPAC Name: 6-(3-imidazol-1-ylpropylamino)-2H-1,2,4-triazine-3,5-dione Traditional Name: 6-(3-imidazol-1-ylpropylamino)-2H-1,2,4-triazine-3,5-quinone Formula: C9H12N6O2 MolecularWeight: 236.23058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=N1)CCCNC2=NNC(=O)NC2=O

Isomeric SMILES

C1=CN(C=N1)CCCNC2=NNC(=O)NC2=O

InChI

InChI=1S/C9H12N6O2/c16-8-7(13-14-9(17)12-8)11-2-1-4-15-5-3-10-6-15/h3,5-6H,1-2,4H2,(H,11,13)(H2,12,14,16,17)