5-[(4-fluorophenyl)methyl-(oxolan-2-ylmethyl)amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 5-[(4-fluorophenyl)methyl-(oxolan-2-ylmethyl)amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-[(4-fluorophenyl)methyl-(tetrahydrofuran-2-ylmethyl)amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-[(4-fluorophenyl)methyl-(2-oxolanylmethyl)amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 5-[(4-fluorophenyl)methyl-(oxolan-2-ylmethyl)amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 5-[(4-fluorobenzyl)-(tetrahydrofurfuryl)amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C21H26FN5O2 MolecularWeight: 399.461843

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)N(CC3CCCO3)CC4=CC=C(C=C4)F)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)N(CC3CCCO3)CC4=CC=C(C=C4)F)C

InChI

InChI=1S/C21H26FN5O2/c1-3-5-17-18-19(26(2)25-17)20(28)24-21(23-18)27(13-16-6-4-11-29-16)12-14-7-9-15(22)10-8-14/h7-10,16H,3-6,11-13H2,1-2H3,(H,23,24,28)