azanylidene-[4-[[2,4-bis(azanyl)pyrimidin-5-yl]methylcarbamoyl]phenyl]imino-azanium

Systemtic Name: azanylidene-[4-[[2,4-bis(azanyl)pyrimidin-5-yl]methylcarbamoyl]phenyl]imino-azanium Openeye Name: [4-[(2,4-diaminopyrimidin-5-yl)methylcarbamoyl]phenyl]imino-imino-ammonium CAS Name: [4-[[(2,4-diamino-5-pyrimidinyl)methylamino]-oxomethyl]phenyl]imino-iminoammonium IUPAC Name: [4-[(2,4-diaminopyrimidin-5-yl)methylcarbamoyl]phenyl]imino-iminoazanium Traditional Name: [4-[(2,4-diaminopyrimidin-5-yl)methylcarbamoyl]phenyl]imino-imino-ammonium Formula: C12H13N8O+ MolecularWeight: 285.28462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCC2=CN=C(N=C2N)N)N=[N+]=N

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCC2=CN=C(N=C2N)N)N=[N+]=N

InChI

InChI=1S/C12H12N8O/c13-10-8(6-17-12(14)18-10)5-16-11(21)7-1-3-9(4-2-7)19-20-15/h1-4,6,15H,5H2,(H4-,13,14,16,17,18,21)/p+1