2-[[3-ethyl-7-oxidanylidene-5-(5-propan-2-ylsulfonyl-2-propoxy-phenyl)-4H-pyrazolo[4,3-d]pyrimidin-1-yl]methyl]pyrrolidine-1-carboxylate

Systemtic Name: 2-[[3-ethyl-7-oxidanylidene-5-(5-propan-2-ylsulfonyl-2-propoxy-phenyl)-4H-pyrazolo[4,3-d]pyrimidin-1-yl]methyl]pyrrolidine-1-carboxylate Openeye Name: 2-[[3-ethyl-5-(5-isopropylsulfonyl-2-propoxy-phenyl)-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-1-yl]methyl]pyrrolidine-1-carboxylate CAS Name: 2-[[3-ethyl-7-oxo-5-(5-propan-2-ylsulfonyl-2-propoxyphenyl)-4H-pyrazolo[4,3-d]pyrimidin-1-yl]methyl]-1-pyrrolidinecarboxylate IUPAC Name: 2-[[3-ethyl-7-oxo-5-(5-propan-2-ylsulfonyl-2-propoxyphenyl)-4H-pyrazolo[4,3-d]pyrimidin-1-yl]methyl]pyrrolidine-1-carboxylate Traditional Name: 2-[[3-ethyl-5-(5-isopropylsulfonyl-2-propoxy-phenyl)-7-keto-4H-pyrazolo[4,3-d]pyrimidin-1-yl]methyl]pyrrolidine-1-carboxylate Formula: C25H32N5O6S- MolecularWeight: 530.61648

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)S(=O)(=O)C(C)C)C2=NC(=O)C3=C(N2)C(=NN3CC4CCCN4C(=O)[O-])CC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)S(=O)(=O)C(C)C)C2=NC(=O)C3=C(N2)C(=NN3CC4CCCN4C(=O)[O-])CC

InChI

InChI=1S/C25H33N5O6S/c1-5-12-36-20-10-9-17(37(34,35)15(3)4)13-18(20)23-26-21-19(6-2)28-30(22(21)24(31)27-23)14-16-8-7-11-29(16)25(32)33/h9-10,13,15-16H,5-8,11-12,14H2,1-4H3,(H,32,33)(H,26,27,31)/p-1