5-(2-butoxy-5-methylsulfonyl-phenyl)-3-ethyl-2-(1-propan-2-ylazetidin-3-yl)-4H-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 5-(2-butoxy-5-methylsulfonyl-phenyl)-3-ethyl-2-(1-propan-2-ylazetidin-3-yl)-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-(2-butoxy-5-methylsulfonyl-phenyl)-3-ethyl-2-(1-isopropylazetidin-3-yl)-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-(2-butoxy-5-methylsulfonylphenyl)-3-ethyl-2-(1-propan-2-yl-3-azetidinyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 5-(2-butoxy-5-methylsulfonylphenyl)-3-ethyl-2-(1-propan-2-ylazetidin-3-yl)-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 5-(2-butoxy-5-mesyl-phenyl)-3-ethyl-2-(1-isopropylazetidin-3-yl)-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C24H33N5O4S MolecularWeight: 487.61492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)S(=O)(=O)C)C2=NC(=O)C3=NN(C(=C3N2)CC)C4CN(C4)C(C)C

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)S(=O)(=O)C)C2=NC(=O)C3=NN(C(=C3N2)CC)C4CN(C4)C(C)C

InChI

InChI=1S/C24H33N5O4S/c1-6-8-11-33-20-10-9-17(34(5,31)32)12-18(20)23-25-21-19(7-2)29(27-22(21)24(30)26-23)16-13-28(14-16)15(3)4/h9-10,12,15-16H,6-8,11,13-14H2,1-5H3,(H,25,26,30)