ethyl 4-[[9-[(4-fluorophenyl)methyl]purin-8-yl]amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[9-[(4-fluorophenyl)methyl]purin-8-yl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[9-[(4-fluorophenyl)methyl]purin-8-yl]amino]piperidine-1-carboxylate CAS Name: 4-[[9-[(4-fluorophenyl)methyl]-8-purinyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[9-[(4-fluorophenyl)methyl]purin-8-yl]amino]piperidine-1-carboxylate Traditional Name: 4-[[9-(4-fluorobenzyl)purin-8-yl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C20H23FN6O2 MolecularWeight: 398.434023

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC2=NC3=CN=CN=C3N2CC4=CC=C(C=C4)F

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC2=NC3=CN=CN=C3N2CC4=CC=C(C=C4)F

InChI

InChI=1S/C20H23FN6O2/c1-2-29-20(28)26-9-7-16(8-10-26)24-19-25-17-11-22-13-23-18(17)27(19)12-14-3-5-15(21)6-4-14/h3-6,11,13,16H,2,7-10,12H2,1H3,(H,24,25)