2-iodanyl-N-(phenylmethyl)-9-propan-2-yl-purin-6-amine

Systemtic Name: 2-iodanyl-N-(phenylmethyl)-9-propan-2-yl-purin-6-amine Openeye Name: N-benzyl-2-iodo-9-isopropyl-purin-6-amine CAS Name: 2-iodo-N-(phenylmethyl)-9-propan-2-yl-6-purinamine IUPAC Name: N-benzyl-2-iodo-9-propan-2-ylpurin-6-amine Traditional Name: benzyl-(2-iodo-9-isopropyl-purin-6-yl)amine Formula: C15H16IN5 MolecularWeight: 393.22551

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=CC=C3)I

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=CC=C3)I

InChI

InChI=1S/C15H16IN5/c1-10(2)21-9-18-12-13(19-15(16)20-14(12)21)17-8-11-6-4-3-5-7-11/h3-7,9-10H,8H2,1-2H3,(H,17,19,20)