2-chloranyl-N-[[6-(3-fluorophenyl)pyridin-3-yl]methyl]-9-propan-2-yl-purin-6-amine

Systemtic Name: 2-chloranyl-N-[[6-(3-fluorophenyl)pyridin-3-yl]methyl]-9-propan-2-yl-purin-6-amine Openeye Name: 2-chloro-N-[[6-(3-fluorophenyl)-3-pyridyl]methyl]-9-isopropyl-purin-6-amine CAS Name: 2-chloro-N-[[6-(3-fluorophenyl)-3-pyridinyl]methyl]-9-propan-2-yl-6-purinamine IUPAC Name: 2-chloro-N-[[6-(3-fluorophenyl)pyridin-3-yl]methyl]-9-propan-2-ylpurin-6-amine Traditional Name: (2-chloro-9-isopropyl-purin-6-yl)-[[6-(3-fluorophenyl)-3-pyridyl]methyl]amine Formula: C20H18ClFN6 MolecularWeight: 396.848523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CN=C(C=C3)C4=CC(=CC=C4)F)Cl

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CN=C(C=C3)C4=CC(=CC=C4)F)Cl

InChI

InChI=1S/C20H18ClFN6/c1-12(2)28-11-25-17-18(26-20(21)27-19(17)28)24-10-13-6-7-16(23-9-13)14-4-3-5-15(22)8-14/h3-9,11-12H,10H2,1-2H3,(H,24,26,27)