2-cyclopentyl-2-[4-[[8-[(4-fluorophenyl)methyl]-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]methyl]phenyl]-N-[(1R)-2-oxidanyl-1-phenyl-ethyl]ethanamide

Systemtic Name: 2-cyclopentyl-2-[4-[[8-[(4-fluorophenyl)methyl]-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]methyl]phenyl]-N-[(1R)-2-oxidanyl-1-phenyl-ethyl]ethanamide Openeye Name: 2-cyclopentyl-2-[4-[[8-[(4-fluorophenyl)methyl]-1,3-dimethyl-2,6-dioxo-purin-7-yl]methyl]phenyl]-N-[(1R)-2-hydroxy-1-phenyl-ethyl]acetamide CAS Name: 2-cyclopentyl-2-[4-[[8-[(4-fluorophenyl)methyl]-1,3-dimethyl-2,6-dioxo-7-purinyl]methyl]phenyl]-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide IUPAC Name: 2-cyclopentyl-2-[4-[[8-[(4-fluorophenyl)methyl]-1,3-dimethyl-2,6-dioxopurin-7-yl]methyl]phenyl]-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide Traditional Name: 2-cyclopentyl-2-[4-[[8-(4-fluorobenzyl)-2,6-diketo-1,3-dimethyl-purin-7-yl]methyl]phenyl]-N-[(1R)-2-hydroxy-1-phenyl-ethyl]acetamide Formula: C36H38FN5O4 MolecularWeight: 623.716423

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CC3=CC=C(C=C3)F)CC4=CC=C(C=C4)C(C5CCCC5)C(=O)NC(CO)C6=CC=CC=C6

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CC3=CC=C(C=C3)F)CC4=CC=C(C=C4)C(C5CCCC5)C(=O)N[C@@H](CO)C6=CC=CC=C6

InChI

InChI=1S/C36H38FN5O4/c1-40-33-32(35(45)41(2)36(40)46)42(30(39-33)20-23-14-18-28(37)19-15-23)21-24-12-16-27(17-13-24)31(26-10-6-7-11-26)34(44)38-29(22-43)25-8-4-3-5-9-25/h3-5,8-9,12-19,26,29,31,43H,6-7,10-11,20-22H2,1-2H3,(H,38,44)/t29-,31?/m0/s1