3-ethyl-5-(5-methylsulfonyl-2-propoxy-phenyl)-2,4-dihydropyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 3-ethyl-5-(5-methylsulfonyl-2-propoxy-phenyl)-2,4-dihydropyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 3-ethyl-5-(5-methylsulfonyl-2-propoxy-phenyl)-2,4-dihydropyrazolo[4,3-d]pyrimidin-7-one CAS Name: 3-ethyl-5-(5-methylsulfonyl-2-propoxyphenyl)-2,4-dihydropyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 3-ethyl-5-(5-methylsulfonyl-2-propoxyphenyl)-2,4-dihydropyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 3-ethyl-5-(5-mesyl-2-propoxy-phenyl)-2,4-dihydropyrazolo[4,3-d]pyrimidin-7-one Formula: C17H20N4O4S MolecularWeight: 376.4301

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)S(=O)(=O)C)C2=NC(=O)C3=NNC(=C3N2)CC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)S(=O)(=O)C)C2=NC(=O)C3=NNC(=C3N2)CC

InChI

InChI=1S/C17H20N4O4S/c1-4-8-25-13-7-6-10(26(3,23)24)9-11(13)16-18-14-12(5-2)20-21-15(14)17(22)19-16/h6-7,9H,4-5,8H2,1-3H3,(H,20,21)(H,18,19,22)