N2,N2-dimethyl-6-[(1S)-1-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethyl]-1,3,5-triazine-2,4-diamine

Systemtic Name: N2,N2-dimethyl-6-[(1S)-1-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethyl]-1,3,5-triazine-2,4-diamine Openeye Name: N2,N2-dimethyl-6-[(1S)-1-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethyl]-1,3,5-triazine-2,4-diamine CAS Name: N2,N2-dimethyl-6-[(1S)-1-[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]ethyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N,2-N-dimethyl-6-[(1S)-1-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[(1S)-1-[4-(2-pyrimidyl)piperazin-1-ium-1-yl]ethyl]-s-triazin-2-yl]-dimethyl-amine Formula: C15H24N9+ MolecularWeight: 330.41136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NC(=N1)N(C)C)N)[NH+]2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

C[C@@H](C1=NC(=NC(=N1)N(C)C)N)[NH+]2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C15H23N9/c1-11(12-19-13(16)21-15(20-12)22(2)3)23-7-9-24(10-8-23)14-17-5-4-6-18-14/h4-6,11H,7-10H2,1-3H3,(H2,16,19,20,21)/p+1/t11-/m0/s1