3-ethyl-5-(5-methylsulfonyl-2-propoxy-phenyl)-1-(pyridin-2-ylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 3-ethyl-5-(5-methylsulfonyl-2-propoxy-phenyl)-1-(pyridin-2-ylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 3-ethyl-5-(5-methylsulfonyl-2-propoxy-phenyl)-1-(2-pyridylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 3-ethyl-5-(5-methylsulfonyl-2-propoxyphenyl)-1-(2-pyridinylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 3-ethyl-5-(5-methylsulfonyl-2-propoxyphenyl)-1-(pyridin-2-ylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 3-ethyl-5-(5-mesyl-2-propoxy-phenyl)-1-(2-pyridylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C23H25N5O4S MolecularWeight: 467.5407

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)S(=O)(=O)C)C2=NC(=O)C3=C(N2)C(=NN3CC4=CC=CC=N4)CC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)S(=O)(=O)C)C2=NC(=O)C3=C(N2)C(=NN3CC4=CC=CC=N4)CC

InChI

InChI=1S/C23H25N5O4S/c1-4-12-32-19-10-9-16(33(3,30)31)13-17(19)22-25-20-18(5-2)27-28(21(20)23(29)26-22)14-15-8-6-7-11-24-15/h6-11,13H,4-5,12,14H2,1-3H3,(H,25,26,29)