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

Systemtic Name: 5-[7-oxidanylidene-3-propyl-2-(pyridin-2-ylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-5-yl]-6-propoxy-pyridine-3-sulfonyl chloride Openeye Name: 5-[7-oxo-3-propyl-2-(2-pyridylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-5-yl]-6-propoxy-pyridine-3-sulfonyl chloride CAS Name: 5-[7-oxo-3-propyl-2-(2-pyridinylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-5-yl]-6-propoxy-3-pyridinesulfonyl chloride IUPAC Name: 5-[7-oxo-3-propyl-2-(pyridin-2-ylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-5-yl]-6-propoxypyridine-3-sulfonyl chloride Traditional Name: 5-[7-keto-3-propyl-2-(2-pyridylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-5-yl]-6-propoxy-pyridine-3-sulfonyl chloride Formula: C22H23ClN6O4S MolecularWeight: 502.97382

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=NN1CC3=CC=CC=N3)C(=O)N=C(N2)C4=CC(=CN=C4OCCC)S(=O)(=O)Cl

Isomeric SMILES

CCCC1=C2C(=NN1CC3=CC=CC=N3)C(=O)N=C(N2)C4=CC(=CN=C4OCCC)S(=O)(=O)Cl

InChI

InChI=1S/C22H23ClN6O4S/c1-3-7-17-18-19(28-29(17)13-14-8-5-6-9-24-14)21(30)27-20(26-18)16-11-15(34(23,31)32)12-25-22(16)33-10-4-2/h5-6,8-9,11-12H,3-4,7,10,13H2,1-2H3,(H,26,27,30)