2-azanyl-3-[4,6-bis(propan-2-ylamino)-1,3,5-triazin-2-yl]-1,4-dihydroimidazol-3-ium-5-one

Systemtic Name: 2-azanyl-3-[4,6-bis(propan-2-ylamino)-1,3,5-triazin-2-yl]-1,4-dihydroimidazol-3-ium-5-one Openeye Name: 2-amino-3-[4,6-bis(isopropylamino)-1,3,5-triazin-2-yl]-1,4-dihydroimidazol-3-ium-5-one CAS Name: 2-amino-3-[4,6-bis(propan-2-ylamino)-1,3,5-triazin-2-yl]-1,4-dihydroimidazol-3-ium-5-one IUPAC Name: 2-amino-3-[4,6-bis(propan-2-ylamino)-1,3,5-triazin-2-yl]-1,4-dihydroimidazol-3-ium-5-one Traditional Name: 2-amino-1-[4,6-bis(isopropylamino)-s-triazin-2-yl]-2-imidazolin-1-ium-4-one Formula: C12H21N8O+ MolecularWeight: 293.34814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC(=NC(=N1)[N+]2=C(NC(=O)C2)N)NC(C)C

Isomeric SMILES

CC(C)NC1=NC(=NC(=N1)[N+]2=C(NC(=O)C2)N)NC(C)C

InChI

InChI=1S/C12H20N8O/c1-6(2)14-10-17-11(15-7(3)4)19-12(18-10)20-5-8(21)16-9(20)13/h6-7H,5H2,1-4H3,(H4,13,14,15,16,17,18,19,21)/p+1