8-(4-fluorophenyl)-2-methyl-9-propyl-N-(4-pyrrolidin-1-ylbutyl)purin-6-amine

Systemtic Name: 8-(4-fluorophenyl)-2-methyl-9-propyl-N-(4-pyrrolidin-1-ylbutyl)purin-6-amine Openeye Name: 8-(4-fluorophenyl)-2-methyl-9-propyl-N-(4-pyrrolidin-1-ylbutyl)purin-6-amine CAS Name: 8-(4-fluorophenyl)-2-methyl-9-propyl-N-[4-(1-pyrrolidinyl)butyl]-6-purinamine IUPAC Name: 8-(4-fluorophenyl)-2-methyl-9-propyl-N-(4-pyrrolidin-1-ylbutyl)purin-6-amine Traditional Name: [8-(4-fluorophenyl)-2-methyl-9-propyl-purin-6-yl]-(4-pyrrolidinobutyl)amine Formula: C23H31FN6 MolecularWeight: 410.530843

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=NC(=N2)C)NCCCCN3CCCC3)N=C1C4=CC=C(C=C4)F

Isomeric SMILES

CCCN1C2=C(C(=NC(=N2)C)NCCCCN3CCCC3)N=C1C4=CC=C(C=C4)F

InChI

InChI=1S/C23H31FN6/c1-3-13-30-22(18-8-10-19(24)11-9-18)28-20-21(26-17(2)27-23(20)30)25-12-4-5-14-29-15-6-7-16-29/h8-11H,3-7,12-16H2,1-2H3,(H,25,26,27)