6-ethoxy-5-[7-oxidanylidene-3-propyl-2-(pyridin-2-ylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-5-yl]pyridine-3-sulfonyl chloride

Systemtic Name: 6-ethoxy-5-[7-oxidanylidene-3-propyl-2-(pyridin-2-ylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-5-yl]pyridine-3-sulfonyl chloride Openeye Name: 6-ethoxy-5-[7-oxo-3-propyl-2-(2-pyridylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-5-yl]pyridine-3-sulfonyl chloride CAS Name: 6-ethoxy-5-[7-oxo-3-propyl-2-(2-pyridinylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-5-yl]-3-pyridinesulfonyl chloride IUPAC Name: 6-ethoxy-5-[7-oxo-3-propyl-2-(pyridin-2-ylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-5-yl]pyridine-3-sulfonyl chloride Traditional Name: 6-ethoxy-5-[7-keto-3-propyl-2-(2-pyridylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-5-yl]pyridine-3-sulfonyl chloride Formula: C21H21ClN6O4S MolecularWeight: 488.94724

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=NN1CC3=CC=CC=N3)C(=O)N=C(N2)C4=CC(=CN=C4OCC)S(=O)(=O)Cl

Isomeric SMILES

CCCC1=C2C(=NN1CC3=CC=CC=N3)C(=O)N=C(N2)C4=CC(=CN=C4OCC)S(=O)(=O)Cl

InChI

InChI=1S/C21H21ClN6O4S/c1-3-7-16-17-18(27-28(16)12-13-8-5-6-9-23-13)20(29)26-19(25-17)15-10-14(33(22,30)31)11-24-21(15)32-4-2/h5-6,8-11H,3-4,7,12H2,1-2H3,(H,25,26,29)