2-chloranyl-4-[3,5-dicyclopropyl-1-(methylsulfonylmethyl)pyrazol-4-yl]oxy-benzenecarbonitrile

Systemtic Name: 2-chloranyl-4-[3,5-dicyclopropyl-1-(methylsulfonylmethyl)pyrazol-4-yl]oxy-benzenecarbonitrile Openeye Name: 2-chloro-4-[3,5-dicyclopropyl-1-(methylsulfonylmethyl)pyrazol-4-yl]oxy-benzonitrile CAS Name: 2-chloro-4-[[3,5-dicyclopropyl-1-(methylsulfonylmethyl)-4-pyrazolyl]oxy]benzonitrile IUPAC Name: 2-chloro-4-[3,5-dicyclopropyl-1-(methylsulfonylmethyl)pyrazol-4-yl]oxybenzonitrile Traditional Name: 2-chloro-4-[3,5-dicyclopropyl-1-(mesylmethyl)pyrazol-4-yl]oxy-benzonitrile Formula: C18H18ClN3O3S MolecularWeight: 391.87182

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CN1C(=C(C(=N1)C2CC2)OC3=CC(=C(C=C3)C#N)Cl)C4CC4

Isomeric SMILES

CS(=O)(=O)CN1C(=C(C(=N1)C2CC2)OC3=CC(=C(C=C3)C#N)Cl)C4CC4

InChI

InChI=1S/C18H18ClN3O3S/c1-26(23,24)10-22-17(12-4-5-12)18(16(21-22)11-2-3-11)25-14-7-6-13(9-20)15(19)8-14/h6-8,11-12H,2-5,10H2,1H3