1-[(2-fluorophenyl)methyl]-3-methyl-8-(3-propan-2-yloxypropylamino)-7H-purine-2,6-dione

Systemtic Name: 1-[(2-fluorophenyl)methyl]-3-methyl-8-(3-propan-2-yloxypropylamino)-7H-purine-2,6-dione Openeye Name: 1-[(2-fluorophenyl)methyl]-8-(3-isopropoxypropylamino)-3-methyl-7H-purine-2,6-dione CAS Name: 1-[(2-fluorophenyl)methyl]-3-methyl-8-(3-propan-2-yloxypropylamino)-7H-purine-2,6-dione IUPAC Name: 1-[(2-fluorophenyl)methyl]-3-methyl-8-(3-propan-2-yloxypropylamino)-7H-purine-2,6-dione Traditional Name: 1-(2-fluorobenzyl)-8-(3-isopropoxypropylamino)-3-methyl-7H-purine-2,6-quinone Formula: C19H24FN5O3 MolecularWeight: 389.423963

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC1=NC2=C(N1)C(=O)N(C(=O)N2C)CC3=CC=CC=C3F

Isomeric SMILES

CC(C)OCCCNC1=NC2=C(N1)C(=O)N(C(=O)N2C)CC3=CC=CC=C3F

InChI

InChI=1S/C19H24FN5O3/c1-12(2)28-10-6-9-21-18-22-15-16(23-18)24(3)19(27)25(17(15)26)11-13-7-4-5-8-14(13)20/h4-5,7-8,12H,6,9-11H2,1-3H3,(H2,21,22,23)