N2-phenyl-6-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-phenyl-6-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,3,5-triazine-2,4-diamine Openeye Name: N2-phenyl-6-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,3,5-triazine-2,4-diamine CAS Name: N2-phenyl-6-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-phenyl-6-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[4-(2-pyrimidyl)piperazino]methyl]-s-triazin-2-yl]-phenyl-amine Formula: C18H21N9 MolecularWeight: 363.41964

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC(=NC(=N2)NC3=CC=CC=C3)N)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCN1CC2=NC(=NC(=N2)NC3=CC=CC=C3)N)C4=NC=CC=N4

InChI

InChI=1S/C18H21N9/c19-16-23-15(24-17(25-16)22-14-5-2-1-3-6-14)13-26-9-11-27(12-10-26)18-20-7-4-8-21-18/h1-8H,9-13H2,(H3,19,22,23,24,25)