2-chloranyl-N-[[6-(3-methoxyphenyl)pyridin-3-yl]methyl]-7H-purin-6-amine

Systemtic Name: 2-chloranyl-N-[[6-(3-methoxyphenyl)pyridin-3-yl]methyl]-7H-purin-6-amine Openeye Name: 2-chloro-N-[[6-(3-methoxyphenyl)-3-pyridyl]methyl]-7H-purin-6-amine CAS Name: 2-chloro-N-[[6-(3-methoxyphenyl)-3-pyridinyl]methyl]-7H-purin-6-amine IUPAC Name: 2-chloro-N-[[6-(3-methoxyphenyl)pyridin-3-yl]methyl]-7H-purin-6-amine Traditional Name: (2-chloro-7H-purin-6-yl)-[[6-(3-methoxyphenyl)-3-pyridyl]methyl]amine Formula: C18H15ClN6O MolecularWeight: 366.8043

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NC=C(C=C2)CNC3=NC(=NC4=C3NC=N4)Cl

Isomeric SMILES

COC1=CC=CC(=C1)C2=NC=C(C=C2)CNC3=NC(=NC4=C3NC=N4)Cl

InChI

InChI=1S/C18H15ClN6O/c1-26-13-4-2-3-12(7-13)14-6-5-11(8-20-14)9-21-16-15-17(23-10-22-15)25-18(19)24-16/h2-8,10H,9H2,1H3,(H2,21,22,23,24,25)