5-(2-ethoxy-5-piperidin-1-ylsulfonyl-pyridin-3-yl)-3-propyl-2-(pyridin-2-ylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 5-(2-ethoxy-5-piperidin-1-ylsulfonyl-pyridin-3-yl)-3-propyl-2-(pyridin-2-ylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-[2-ethoxy-5-(1-piperidylsulfonyl)-3-pyridyl]-3-propyl-2-(2-pyridylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-[2-ethoxy-5-(1-piperidinylsulfonyl)-3-pyridinyl]-3-propyl-2-(2-pyridinylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 5-(2-ethoxy-5-piperidin-1-ylsulfonylpyridin-3-yl)-3-propyl-2-(pyridin-2-ylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 5-(2-ethoxy-5-piperidinosulfonyl-3-pyridyl)-3-propyl-2-(2-pyridylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C26H31N7O4S MolecularWeight: 537.63384

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=NN1CC3=CC=CC=N3)C(=O)N=C(N2)C4=CC(=CN=C4OCC)S(=O)(=O)N5CCCCC5

Isomeric SMILES

CCCC1=C2C(=NN1CC3=CC=CC=N3)C(=O)N=C(N2)C4=CC(=CN=C4OCC)S(=O)(=O)N5CCCCC5

InChI

InChI=1S/C26H31N7O4S/c1-3-10-21-22-23(31-33(21)17-18-11-6-7-12-27-18)25(34)30-24(29-22)20-15-19(16-28-26(20)37-4-2)38(35,36)32-13-8-5-9-14-32/h6-7,11-12,15-16H,3-5,8-10,13-14,17H2,1-2H3,(H,29,30,34)