5-[3,3-dimethylbutyl(2-morpholin-4-ylethyl)amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 5-[3,3-dimethylbutyl(2-morpholin-4-ylethyl)amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-[3,3-dimethylbutyl(2-morpholinoethyl)amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-[3,3-dimethylbutyl-[2-(4-morpholinyl)ethyl]amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 5-[3,3-dimethylbutyl(2-morpholin-4-ylethyl)amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 5-[3,3-dimethylbutyl(2-morpholinoethyl)amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C21H36N6O2 MolecularWeight: 404.54954

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)N(CCC(C)(C)C)CCN3CCOCC3)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)N(CCC(C)(C)C)CCN3CCOCC3)C

InChI

InChI=1S/C21H36N6O2/c1-6-7-16-17-18(25(5)24-16)19(28)23-20(22-17)27(9-8-21(2,3)4)11-10-26-12-14-29-15-13-26/h6-15H2,1-5H3,(H,22,23,28)