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9-butan-2-yl-2-chloranyl-N-[(3-iodanylphenyl)methyl]purin-6-amine

9-butan-2-yl-2-chloranyl-N-[(3-iodanylphenyl)methyl]purin-6-amine

Systemtic Name:9-butan-2-yl-2-chloranyl-N-[(3-iodanylphenyl)methyl]purin-6-amine
Openeye Name:2-chloro-N-[(3-iodophenyl)methyl]-9-sec-butyl-purin-6-amine
CAS Name:9-butan-2-yl-2-chloro-N-[(3-iodophenyl)methyl]-6-purinamine
IUPAC Name:9-butan-2-yl-2-chloro-N-[(3-iodophenyl)methyl]purin-6-amine
Traditional Name:(2-chloro-9-sec-butyl-purin-6-yl)-(3-iodobenzyl)amine
Formula: C16H17ClIN5
MolecularWeight: 441.69715
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C16H17ClIN5/c1-3-10(2)23-9-20-13-14(21-16(17)22-15(13)23)19-8-11-5-4-6-12(18)7-11/h4-7,9-10H,3,8H2,1-2H3,(H,19,21,22)


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