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N2-(4-methylphenyl)-6-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-1,3,5-triazine-2,4-diamine

N2-(4-methylphenyl)-6-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-1,3,5-triazine-2,4-diamine

Systemtic Name:N2-(4-methylphenyl)-6-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-1,3,5-triazine-2,4-diamine
Openeye Name:6-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-N2-(p-tolyl)-1,3,5-triazine-2,4-diamine
CAS Name:N2-(4-methylphenyl)-6-[(4-methyl-1-piperazine-1,4-diiumyl)methyl]-1,3,5-triazine-2,4-diamine
IUPAC Name:2-N-(4-methylphenyl)-6-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-1,3,5-triazine-2,4-diamine
Traditional Name:[4-amino-6-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-s-triazin-2-yl]-(p-tolyl)amine
Formula: C16H25N7+2
MolecularWeight: 315.4166
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)C[NH+]3CC[NH+](CC3)C


Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)C[NH+]3CC[NH+](CC3)C


InChI

InChI=1S/C16H23N7/c1-12-3-5-13(6-4-12)18-16-20-14(19-15(17)21-16)11-23-9-7-22(2)8-10-23/h3-6H,7-11H2,1-2H3,(H3,17,18,19,20,21)/p+2


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