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

Systemtic Name: N2-(4-methylphenyl)-6-[(4-phenethylpiperazin-1-yl)methyl]-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(4-phenethylpiperazin-1-yl)methyl]-N2-(p-tolyl)-1,3,5-triazine-2,4-diamine CAS Name: N2-(4-methylphenyl)-6-[(4-phenethyl-1-piperazinyl)methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(4-methylphenyl)-6-[(4-phenethylpiperazin-1-yl)methyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[(4-phenethylpiperazino)methyl]-s-triazin-2-yl]-(p-tolyl)amine Formula: C23H29N7 MolecularWeight: 403.52326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CN3CCN(CC3)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CN3CCN(CC3)CCC4=CC=CC=C4

InChI

InChI=1S/C23H29N7/c1-18-7-9-20(10-8-18)25-23-27-21(26-22(24)28-23)17-30-15-13-29(14-16-30)12-11-19-5-3-2-4-6-19/h2-10H,11-17H2,1H3,(H3,24,25,26,27,28)