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

Systemtic Name: 5-(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)-3-methyl-1-propyl-3,4-dihydro-2H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-[2-ethoxy-5-(1-piperidylsulfonyl)phenyl]-3-methyl-1-propyl-3,4-dihydro-2H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-[2-ethoxy-5-(1-piperidinylsulfonyl)phenyl]-3-methyl-1-propyl-3,4-dihydro-2H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 5-(2-ethoxy-5-piperidin-1-ylsulfonylphenyl)-3-methyl-1-propyl-3,4-dihydro-2H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 5-(2-ethoxy-5-piperidinosulfonyl-phenyl)-3-methyl-1-propyl-3,4-dihydro-2H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C22H31N5O4S MolecularWeight: 461.57764

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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)OCC

Isomeric SMILES

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

InChI

InChI=1S/C22H31N5O4S/c1-4-11-27-20-19(15(3)25-27)23-21(24-22(20)28)17-14-16(9-10-18(17)31-5-2)32(29,30)26-12-7-6-8-13-26/h9-10,14-15,25H,4-8,11-13H2,1-3H3,(H,23,24,28)