3-ethyl-2-(1-methylpiperidin-4-yl)-5-[2-(2-methylpropoxy)-5-methylsulfonyl-phenyl]-4H-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 3-ethyl-2-(1-methylpiperidin-4-yl)-5-[2-(2-methylpropoxy)-5-methylsulfonyl-phenyl]-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 3-ethyl-5-(2-isobutoxy-5-methylsulfonyl-phenyl)-2-(1-methyl-4-piperidyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 3-ethyl-2-(1-methyl-4-piperidinyl)-5-[2-(2-methylpropoxy)-5-methylsulfonylphenyl]-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 3-ethyl-2-(1-methylpiperidin-4-yl)-5-[2-(2-methylpropoxy)-5-methylsulfonylphenyl]-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 3-ethyl-5-(2-isobutoxy-5-mesyl-phenyl)-2-(1-methyl-4-piperidyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C24H33N5O4S MolecularWeight: 487.61492

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=NN1C3CCN(CC3)C)C(=O)N=C(N2)C4=C(C=CC(=C4)S(=O)(=O)C)OCC(C)C

Isomeric SMILES

CCC1=C2C(=NN1C3CCN(CC3)C)C(=O)N=C(N2)C4=C(C=CC(=C4)S(=O)(=O)C)OCC(C)C

InChI

InChI=1S/C24H33N5O4S/c1-6-19-21-22(27-29(19)16-9-11-28(4)12-10-16)24(30)26-23(25-21)18-13-17(34(5,31)32)7-8-20(18)33-14-15(2)3/h7-8,13,15-16H,6,9-12,14H2,1-5H3,(H,25,26,30)