N-[(3-iodanylphenyl)methyl]-9-methyl-2-pyridin-4-ylsulfanyl-purin-6-amine

Systemtic Name: N-[(3-iodanylphenyl)methyl]-9-methyl-2-pyridin-4-ylsulfanyl-purin-6-amine Openeye Name: N-[(3-iodophenyl)methyl]-9-methyl-2-(4-pyridylsulfanyl)purin-6-amine CAS Name: N-[(3-iodophenyl)methyl]-9-methyl-2-(pyridin-4-ylthio)-6-purinamine IUPAC Name: N-[(3-iodophenyl)methyl]-9-methyl-2-pyridin-4-ylsulfanylpurin-6-amine Traditional Name: (3-iodobenzyl)-[9-methyl-2-(4-pyridylthio)purin-6-yl]amine Formula: C18H15IN6S MolecularWeight: 474.32137

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1N=C(N=C2NCC3=CC(=CC=C3)I)SC4=CC=NC=C4

Isomeric SMILES

CN1C=NC2=C1N=C(N=C2NCC3=CC(=CC=C3)I)SC4=CC=NC=C4

InChI

InChI=1S/C18H15IN6S/c1-25-11-22-15-16(21-10-12-3-2-4-13(19)9-12)23-18(24-17(15)25)26-14-5-7-20-8-6-14/h2-9,11H,10H2,1H3,(H,21,23,24)