8-(4-fluorophenyl)-2-methyl-N-[1-(phenylmethyl)pyrrolidin-3-yl]-9-propyl-purin-6-amine

Systemtic Name: 8-(4-fluorophenyl)-2-methyl-N-[1-(phenylmethyl)pyrrolidin-3-yl]-9-propyl-purin-6-amine Openeye Name: N-(1-benzylpyrrolidin-3-yl)-8-(4-fluorophenyl)-2-methyl-9-propyl-purin-6-amine CAS Name: 8-(4-fluorophenyl)-2-methyl-N-[1-(phenylmethyl)-3-pyrrolidinyl]-9-propyl-6-purinamine IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-8-(4-fluorophenyl)-2-methyl-9-propylpurin-6-amine Traditional Name: (1-benzylpyrrolidin-3-yl)-[8-(4-fluorophenyl)-2-methyl-9-propyl-purin-6-yl]amine Formula: C26H29FN6 MolecularWeight: 444.547063

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=NC(=N2)C)NC3CCN(C3)CC4=CC=CC=C4)N=C1C5=CC=C(C=C5)F

Isomeric SMILES

CCCN1C2=C(C(=NC(=N2)C)NC3CCN(C3)CC4=CC=CC=C4)N=C1C5=CC=C(C=C5)F

InChI

InChI=1S/C26H29FN6/c1-3-14-33-25(20-9-11-21(27)12-10-20)31-23-24(28-18(2)29-26(23)33)30-22-13-15-32(17-22)16-19-7-5-4-6-8-19/h4-12,22H,3,13-17H2,1-2H3,(H,28,29,30)