3-methyl-5-(5-piperidin-1-ylsulfonyl-2-propoxy-phenyl)-1-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 3-methyl-5-(5-piperidin-1-ylsulfonyl-2-propoxy-phenyl)-1-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 3-methyl-5-[5-(1-piperidylsulfonyl)-2-propoxy-phenyl]-1-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 3-methyl-5-[5-(1-piperidinylsulfonyl)-2-propoxyphenyl]-1-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 3-methyl-5-(5-piperidin-1-ylsulfonyl-2-propoxyphenyl)-1-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 3-methyl-5-(5-piperidinosulfonyl-2-propoxy-phenyl)-1-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C23H31N5O4S MolecularWeight: 473.58834

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=N1)C)NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)OCCC

Isomeric SMILES

CCCN1C2=C(C(=N1)C)NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)OCCC

InChI

InChI=1S/C23H31N5O4S/c1-4-11-28-21-20(16(3)26-28)24-22(25-23(21)29)18-15-17(9-10-19(18)32-14-5-2)33(30,31)27-12-7-6-8-13-27/h9-10,15H,4-8,11-14H2,1-3H3,(H,24,25,29)