9-methyl-N-[4-(methylaminomethyl)phenyl]-8-pyridin-4-yl-purin-2-amine

Systemtic Name: 9-methyl-N-[4-(methylaminomethyl)phenyl]-8-pyridin-4-yl-purin-2-amine Openeye Name: 9-methyl-N-[4-(methylaminomethyl)phenyl]-8-(4-pyridyl)purin-2-amine CAS Name: 9-methyl-N-[4-(methylaminomethyl)phenyl]-8-pyridin-4-yl-2-purinamine IUPAC Name: 9-methyl-N-[4-(methylaminomethyl)phenyl]-8-pyridin-4-ylpurin-2-amine Traditional Name: methyl-[4-[[9-methyl-8-(4-pyridyl)purin-2-yl]amino]benzyl]amine Formula: C19H19N7 MolecularWeight: 345.40106

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=CC=C(C=C1)NC2=NC=C3C(=N2)N(C(=N3)C4=CC=NC=C4)C

Isomeric SMILES

CNCC1=CC=C(C=C1)NC2=NC=C3C(=N2)N(C(=N3)C4=CC=NC=C4)C

InChI

InChI=1S/C19H19N7/c1-20-11-13-3-5-15(6-4-13)23-19-22-12-16-18(25-19)26(2)17(24-16)14-7-9-21-10-8-14/h3-10,12,20H,11H2,1-2H3,(H,22,23,25)