5-[cyclohexylmethyl-[(3-morpholin-4-ylphenyl)methyl]amino]-1-ethyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 5-[cyclohexylmethyl-[(3-morpholin-4-ylphenyl)methyl]amino]-1-ethyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-[cyclohexylmethyl-[(3-morpholinophenyl)methyl]amino]-1-ethyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-[cyclohexylmethyl-[[3-(4-morpholinyl)phenyl]methyl]amino]-1-ethyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 5-[cyclohexylmethyl-[(3-morpholin-4-ylphenyl)methyl]amino]-1-ethyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 5-[cyclohexylmethyl-(3-morpholinobenzyl)amino]-1-ethyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C28H40N6O2 MolecularWeight: 492.6562

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)N(CC3CCCCC3)CC4=CC(=CC=C4)N5CCOCC5)CC

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)N(CC3CCCCC3)CC4=CC(=CC=C4)N5CCOCC5)CC

InChI

InChI=1S/C28H40N6O2/c1-3-9-24-25-26(34(4-2)31-24)27(35)30-28(29-25)33(19-21-10-6-5-7-11-21)20-22-12-8-13-23(18-22)32-14-16-36-17-15-32/h8,12-13,18,21H,3-7,9-11,14-17,19-20H2,1-2H3,(H,29,30,35)