4-morpholin-4-yl-6-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]-1,3,5-triazin-2-amine

Systemtic Name: 4-morpholin-4-yl-6-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]-1,3,5-triazin-2-amine Openeye Name: 4-morpholino-6-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]-1,3,5-triazin-2-amine CAS Name: 4-(4-morpholinyl)-6-[[4-(2-pyridin-1-iumyl)-1-piperazinyl]methyl]-1,3,5-triazin-2-amine IUPAC Name: 4-morpholin-4-yl-6-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]-1,3,5-triazin-2-amine Traditional Name: [4-morpholino-6-[(4-pyridin-1-ium-2-ylpiperazino)methyl]-s-triazin-2-yl]amine Formula: C17H25N8O+ MolecularWeight: 357.4334

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC(=NC(=N2)N)N3CCOCC3)C4=CC=CC=[NH+]4

Isomeric SMILES

C1CN(CCN1CC2=NC(=NC(=N2)N)N3CCOCC3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C17H24N8O/c18-16-20-14(21-17(22-16)25-9-11-26-12-10-25)13-23-5-7-24(8-6-23)15-3-1-2-4-19-15/h1-4H,5-13H2,(H2,18,20,21,22)/p+1