4-azanyl-3-(3-imidazol-1-ylpropylamino)-1,2,4-triazin-5-one

Systemtic Name: 4-azanyl-3-(3-imidazol-1-ylpropylamino)-1,2,4-triazin-5-one Openeye Name: 4-amino-3-(3-imidazol-1-ylpropylamino)-1,2,4-triazin-5-one CAS Name: 4-amino-3-[3-(1-imidazolyl)propylamino]-1,2,4-triazin-5-one IUPAC Name: 4-amino-3-(3-imidazol-1-ylpropylamino)-1,2,4-triazin-5-one Traditional Name: 4-amino-3-(3-imidazol-1-ylpropylamino)-1,2,4-triazin-5-one Formula: C9H13N7O MolecularWeight: 235.24582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=N1)CCCNC2=NN=CC(=O)N2N

Isomeric SMILES

C1=CN(C=N1)CCCNC2=NN=CC(=O)N2N

InChI

InChI=1S/C9H13N7O/c10-16-8(17)6-13-14-9(16)12-2-1-4-15-5-3-11-7-15/h3,5-7H,1-2,4,10H2,(H,12,14)