N-[9-[(4-fluorophenyl)methyl]purin-6-yl]-N'-propan-2-yl-ethane-1,2-diamine

Systemtic Name: N-[9-[(4-fluorophenyl)methyl]purin-6-yl]-N'-propan-2-yl-ethane-1,2-diamine Openeye Name: N-[9-[(4-fluorophenyl)methyl]purin-6-yl]-N'-isopropyl-ethane-1,2-diamine CAS Name: N-[9-[(4-fluorophenyl)methyl]-6-purinyl]-N'-propan-2-ylethane-1,2-diamine IUPAC Name: N-[9-[(4-fluorophenyl)methyl]purin-6-yl]-N'-propan-2-ylethane-1,2-diamine Traditional Name: [9-(4-fluorobenzyl)purin-6-yl]-[2-(isopropylamino)ethyl]amine Formula: C17H21FN6 MolecularWeight: 328.387243

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCCNC1=NC=NC2=C1N=CN2CC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)NCCNC1=NC=NC2=C1N=CN2CC3=CC=C(C=C3)F

InChI

InChI=1S/C17H21FN6/c1-12(2)19-7-8-20-16-15-17(22-10-21-16)24(11-23-15)9-13-3-5-14(18)6-4-13/h3-6,10-12,19H,7-9H2,1-2H3,(H,20,21,22)