N-[4-ethoxy-3-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]sulfonyl-4-fluoranyl-benzamide

Systemtic Name: N-[4-ethoxy-3-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]sulfonyl-4-fluoranyl-benzamide Openeye Name: N-[4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]sulfonyl-4-fluoro-benzamide CAS Name: N-[4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]sulfonyl-4-fluorobenzamide IUPAC Name: N-[4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]sulfonyl-4-fluorobenzamide Traditional Name: N-[4-ethoxy-3-(7-keto-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]sulfonyl-4-fluoro-benzamide Formula: C24H24FN5O5S MolecularWeight: 513.541263

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)NC(=O)C4=CC=C(C=C4)F)OCC)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)NC(=O)C4=CC=C(C=C4)F)OCC)C

InChI

InChI=1S/C24H24FN5O5S/c1-4-6-18-20-21(30(3)28-18)24(32)27-22(26-20)17-13-16(11-12-19(17)35-5-2)36(33,34)29-23(31)14-7-9-15(25)10-8-14/h7-13H,4-6H2,1-3H3,(H,29,31)(H,26,27,32)