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

Systemtic Name: 5-[cyclohexylmethyl-[(3-morpholin-4-ylphenyl)methyl]amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-[cyclohexylmethyl-[(3-morpholinophenyl)methyl]amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-[cyclohexylmethyl-[[3-(4-morpholinyl)phenyl]methyl]amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 5-[cyclohexylmethyl-[(3-morpholin-4-ylphenyl)methyl]amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 5-[cyclohexylmethyl-(3-morpholinobenzyl)amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C27H38N6O2 MolecularWeight: 478.62962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H38N6O2/c1-3-8-23-24-25(31(2)30-23)26(34)29-27(28-24)33(18-20-9-5-4-6-10-20)19-21-11-7-12-22(17-21)32-13-15-35-16-14-32/h7,11-12,17,20H,3-6,8-10,13-16,18-19H2,1-2H3,(H,28,29,34)