2-iodanyl-N-[(3-methoxyphenyl)methyl]-9-propan-2-yl-purin-6-amine

Systemtic Name: 2-iodanyl-N-[(3-methoxyphenyl)methyl]-9-propan-2-yl-purin-6-amine Openeye Name: 2-iodo-9-isopropyl-N-[(3-methoxyphenyl)methyl]purin-6-amine CAS Name: 2-iodo-N-[(3-methoxyphenyl)methyl]-9-propan-2-yl-6-purinamine IUPAC Name: 2-iodo-N-[(3-methoxyphenyl)methyl]-9-propan-2-ylpurin-6-amine Traditional Name: (2-iodo-9-isopropyl-purin-6-yl)-m-anisyl-amine Formula: C16H18IN5O MolecularWeight: 423.25149

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18IN5O/c1-10(2)22-9-19-13-14(20-16(17)21-15(13)22)18-8-11-5-4-6-12(7-11)23-3/h4-7,9-10H,8H2,1-3H3,(H,18,20,21)