N6-[(4-methylphenyl)methyl]-N4-(pyridin-3-ylmethyl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-[(4-methylphenyl)methyl]-N4-(pyridin-3-ylmethyl)pyrimidine-4,5,6-triamine Openeye Name: N6-(p-tolylmethyl)-N4-(3-pyridylmethyl)pyrimidine-4,5,6-triamine CAS Name: N6-[(4-methylphenyl)methyl]-N4-(3-pyridinylmethyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-[(4-methylphenyl)methyl]-4-N-(pyridin-3-ylmethyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-[(4-methylbenzyl)amino]pyrimidin-4-yl]-(3-pyridylmethyl)amine Formula: C18H20N6 MolecularWeight: 320.3916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=C(C(=NC=N2)NCC3=CN=CC=C3)N

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=C(C(=NC=N2)NCC3=CN=CC=C3)N

InChI

InChI=1S/C18H20N6/c1-13-4-6-14(7-5-13)10-21-17-16(19)18(24-12-23-17)22-11-15-3-2-8-20-9-15/h2-9,12H,10-11,19H2,1H3,(H2,21,22,23,24)