9-[[2,6-bis(fluoranyl)phenyl]methyl]-2-(2-methylbutylsulfanyl)purin-6-amine

Systemtic Name: 9-[[2,6-bis(fluoranyl)phenyl]methyl]-2-(2-methylbutylsulfanyl)purin-6-amine Openeye Name: 9-[(2,6-difluorophenyl)methyl]-2-(2-methylbutylsulfanyl)purin-6-amine CAS Name: 9-[(2,6-difluorophenyl)methyl]-2-(2-methylbutylthio)-6-purinamine IUPAC Name: 9-[(2,6-difluorophenyl)methyl]-2-(2-methylbutylsulfanyl)purin-6-amine Traditional Name: [9-(2,6-difluorobenzyl)-2-(2-methylbutylthio)purin-6-yl]amine Formula: C17H19F2N5S MolecularWeight: 363.428066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CSC1=NC2=C(C(=N1)N)N=CN2CC3=C(C=CC=C3F)F

Isomeric SMILES

CCC(C)CSC1=NC2=C(C(=N1)N)N=CN2CC3=C(C=CC=C3F)F

InChI

InChI=1S/C17H19F2N5S/c1-3-10(2)8-25-17-22-15(20)14-16(23-17)24(9-21-14)7-11-12(18)5-4-6-13(11)19/h4-6,9-10H,3,7-8H2,1-2H3,(H2,20,22,23)