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

Systemtic Name: 1-methyl-5-[(3-morpholin-4-ylphenyl)methyl-(3-phenylpropyl)amino]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 1-methyl-5-[(3-morpholinophenyl)methyl-(3-phenylpropyl)amino]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 1-methyl-5-[[3-(4-morpholinyl)phenyl]methyl-(3-phenylpropyl)amino]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 1-methyl-5-[(3-morpholin-4-ylphenyl)methyl-(3-phenylpropyl)amino]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 1-methyl-5-[(3-morpholinobenzyl)-(3-phenylpropyl)amino]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C29H36N6O2 MolecularWeight: 500.63514

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)N(CCCC3=CC=CC=C3)CC4=CC(=CC=C4)N5CCOCC5)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)N(CCCC3=CC=CC=C3)CC4=CC(=CC=C4)N5CCOCC5)C

InChI

InChI=1S/C29H36N6O2/c1-3-9-25-26-27(33(2)32-25)28(36)31-29(30-26)35(15-8-13-22-10-5-4-6-11-22)21-23-12-7-14-24(20-23)34-16-18-37-19-17-34/h4-7,10-12,14,20H,3,8-9,13,15-19,21H2,1-2H3,(H,30,31,36)