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

Systemtic Name: 4-morpholin-4-yl-6-[[4-(phenylmethyl)piperazin-1-ium-1-yl]methyl]-1,3,5-triazin-2-amine Openeye Name: 4-[(4-benzylpiperazin-1-ium-1-yl)methyl]-6-morpholino-1,3,5-triazin-2-amine CAS Name: 4-(4-morpholinyl)-6-[[4-(phenylmethyl)-1-piperazin-1-iumyl]methyl]-1,3,5-triazin-2-amine IUPAC Name: 4-[(4-benzylpiperazin-1-ium-1-yl)methyl]-6-morpholin-4-yl-1,3,5-triazin-2-amine Traditional Name: [4-[(4-benzylpiperazin-1-ium-1-yl)methyl]-6-morpholino-s-triazin-2-yl]amine Formula: C19H28N7O+ MolecularWeight: 370.47192

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=NC(=NC(=N2)N)N3CCOCC3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=NC(=NC(=N2)N)N3CCOCC3)CC4=CC=CC=C4

InChI

InChI=1S/C19H27N7O/c20-18-21-17(22-19(23-18)26-10-12-27-13-11-26)15-25-8-6-24(7-9-25)14-16-4-2-1-3-5-16/h1-5H,6-15H2,(H2,20,21,22,23)/p+1