[4-(3-chloranyl-4-cyano-phenoxy)-5-cyclobutyl-2-(methylsulfonylmethyl)pyrazol-3-yl]methyl dihydrogen phosphate

Systemtic Name: [4-(3-chloranyl-4-cyano-phenoxy)-5-cyclobutyl-2-(methylsulfonylmethyl)pyrazol-3-yl]methyl dihydrogen phosphate Openeye Name: [4-(3-chloro-4-cyano-phenoxy)-5-cyclobutyl-2-(methylsulfonylmethyl)pyrazol-3-yl]methyl dihydrogen phosphate CAS Name: [4-(3-chloro-4-cyanophenoxy)-5-cyclobutyl-2-(methylsulfonylmethyl)-3-pyrazolyl]methyl dihydrogen phosphate IUPAC Name: [4-(3-chloro-4-cyanophenoxy)-5-cyclobutyl-2-(methylsulfonylmethyl)pyrazol-3-yl]methyl dihydrogen phosphate Traditional Name: [4-(3-chloro-4-cyano-phenoxy)-5-cyclobutyl-2-(mesylmethyl)pyrazol-3-yl]methyl dihydrogen phosphate Formula: C17H19ClN3O7PS MolecularWeight: 475.840421

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CN1C(=C(C(=N1)C2CCC2)OC3=CC(=C(C=C3)C#N)Cl)COP(=O)(O)O

Isomeric SMILES

CS(=O)(=O)CN1C(=C(C(=N1)C2CCC2)OC3=CC(=C(C=C3)C#N)Cl)COP(=O)(O)O

InChI

InChI=1S/C17H19ClN3O7PS/c1-30(25,26)10-21-15(9-27-29(22,23)24)17(16(20-21)11-3-2-4-11)28-13-6-5-12(8-19)14(18)7-13/h5-7,11H,2-4,9-10H2,1H3,(H2,22,23,24)