8-[1-[(3-fluorophenyl)methyl]pyrazol-4-yl]-3-methyl-1-propyl-7H-purine-2,6-dione

Systemtic Name: 8-[1-[(3-fluorophenyl)methyl]pyrazol-4-yl]-3-methyl-1-propyl-7H-purine-2,6-dione Openeye Name: 8-[1-[(3-fluorophenyl)methyl]pyrazol-4-yl]-3-methyl-1-propyl-7H-purine-2,6-dione CAS Name: 8-[1-[(3-fluorophenyl)methyl]-4-pyrazolyl]-3-methyl-1-propyl-7H-purine-2,6-dione IUPAC Name: 8-[1-[(3-fluorophenyl)methyl]pyrazol-4-yl]-3-methyl-1-propyl-7H-purine-2,6-dione Traditional Name: 8-[1-(3-fluorobenzyl)pyrazol-4-yl]-3-methyl-1-propyl-7H-purine-2,6-quinone Formula: C19H19FN6O2 MolecularWeight: 382.391563

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(N=C(N2)C3=CN(N=C3)CC4=CC(=CC=C4)F)N(C1=O)C

Isomeric SMILES

CCCN1C(=O)C2=C(N=C(N2)C3=CN(N=C3)CC4=CC(=CC=C4)F)N(C1=O)C

InChI

InChI=1S/C19H19FN6O2/c1-3-7-26-18(27)15-17(24(2)19(26)28)23-16(22-15)13-9-21-25(11-13)10-12-5-4-6-14(20)8-12/h4-6,8-9,11H,3,7,10H2,1-2H3,(H,22,23)