6-[(2-fluorophenyl)methylsulfanyl]-9-(2-methylbutyl)purin-2-amine

Systemtic Name: 6-[(2-fluorophenyl)methylsulfanyl]-9-(2-methylbutyl)purin-2-amine Openeye Name: 6-[(2-fluorophenyl)methylsulfanyl]-9-(2-methylbutyl)purin-2-amine CAS Name: 6-[(2-fluorophenyl)methylthio]-9-(2-methylbutyl)-2-purinamine IUPAC Name: 6-[(2-fluorophenyl)methylsulfanyl]-9-(2-methylbutyl)purin-2-amine Traditional Name: [6-[(2-fluorobenzyl)thio]-9-(2-methylbutyl)purin-2-yl]amine Formula: C17H20FN5S MolecularWeight: 345.437603

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CN1C=NC2=C1N=C(N=C2SCC3=CC=CC=C3F)N

Isomeric SMILES

CCC(C)CN1C=NC2=C1N=C(N=C2SCC3=CC=CC=C3F)N

InChI

InChI=1S/C17H20FN5S/c1-3-11(2)8-23-10-20-14-15(23)21-17(19)22-16(14)24-9-12-6-4-5-7-13(12)18/h4-7,10-11H,3,8-9H2,1-2H3,(H2,19,21,22)