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

Systemtic Name: 5-[2-ethoxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-pyridin-3-yl]-3-propyl-2-(pyridin-2-ylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-[2-ethoxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-3-pyridyl]-3-propyl-2-(2-pyridylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-[2-ethoxy-5-[[4-(2-hydroxyethyl)-1-piperazinyl]sulfonyl]-3-pyridinyl]-3-propyl-2-(2-pyridinylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 5-[2-ethoxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonylpyridin-3-yl]-3-propyl-2-(pyridin-2-ylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 5-[2-ethoxy-5-[4-(2-hydroxyethyl)piperazino]sulfonyl-3-pyridyl]-3-propyl-2-(2-pyridylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C27H34N8O5S MolecularWeight: 582.67446

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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)N5CCN(CC5)CCO

Isomeric SMILES

CCCC1=C2C(=NN1CC3=CC=CC=N3)C(=O)N=C(N2)C4=CC(=CN=C4OCC)S(=O)(=O)N5CCN(CC5)CCO

InChI

InChI=1S/C27H34N8O5S/c1-3-7-22-23-24(32-35(22)18-19-8-5-6-9-28-19)26(37)31-25(30-23)21-16-20(17-29-27(21)40-4-2)41(38,39)34-12-10-33(11-13-34)14-15-36/h5-6,8-9,16-17,36H,3-4,7,10-15,18H2,1-2H3,(H,30,31,37)