2-fluoranyl-8-(2-iodanyl-5-methoxy-phenyl)sulfanyl-9-(4-methylpent-3-enyl)purin-6-amine

Systemtic Name: 2-fluoranyl-8-(2-iodanyl-5-methoxy-phenyl)sulfanyl-9-(4-methylpent-3-enyl)purin-6-amine Openeye Name: 2-fluoro-8-(2-iodo-5-methoxy-phenyl)sulfanyl-9-(4-methylpent-3-enyl)purin-6-amine CAS Name: 2-fluoro-8-[(2-iodo-5-methoxyphenyl)thio]-9-(4-methylpent-3-enyl)-6-purinamine IUPAC Name: 2-fluoro-8-(2-iodo-5-methoxyphenyl)sulfanyl-9-(4-methylpent-3-enyl)purin-6-amine Traditional Name: [2-fluoro-8-[(2-iodo-5-methoxy-phenyl)thio]-9-(4-methylpent-3-enyl)purin-6-yl]amine Formula: C18H19FIN5OS MolecularWeight: 499.344233

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCN1C2=C(C(=NC(=N2)F)N)N=C1SC3=C(C=CC(=C3)OC)I)C

Isomeric SMILES

CC(=CCCN1C2=C(C(=NC(=N2)F)N)N=C1SC3=C(C=CC(=C3)OC)I)C

InChI

InChI=1S/C18H19FIN5OS/c1-10(2)5-4-8-25-16-14(15(21)23-17(19)24-16)22-18(25)27-13-9-11(26-3)6-7-12(13)20/h5-7,9H,4,8H2,1-3H3,(H2,21,23,24)