1-(5-methylsulfonylpyridin-2-yl)-5-(oxan-2-yloxyamino)-3-(trifluoromethyl)pyrazole-4-carbonitrile

Systemtic Name: 1-(5-methylsulfonylpyridin-2-yl)-5-(oxan-2-yloxyamino)-3-(trifluoromethyl)pyrazole-4-carbonitrile Openeye Name: 1-(5-methylsulfonyl-2-pyridyl)-5-(tetrahydropyran-2-yloxyamino)-3-(trifluoromethyl)pyrazole-4-carbonitrile CAS Name: 1-(5-methylsulfonyl-2-pyridinyl)-5-(2-oxanyloxyamino)-3-(trifluoromethyl)-4-pyrazolecarbonitrile IUPAC Name: 1-(5-methylsulfonylpyridin-2-yl)-5-(oxan-2-yloxyamino)-3-(trifluoromethyl)pyrazole-4-carbonitrile Traditional Name: 1-(5-mesyl-2-pyridyl)-5-(tetrahydropyran-2-yloxyamino)-3-(trifluoromethyl)pyrazole-4-carbonitrile Formula: C16H16F3N5O4S MolecularWeight: 431.38955

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CN=C(C=C1)N2C(=C(C(=N2)C(F)(F)F)C#N)NOC3CCCCO3

Isomeric SMILES

CS(=O)(=O)C1=CN=C(C=C1)N2C(=C(C(=N2)C(F)(F)F)C#N)NOC3CCCCO3

InChI

InChI=1S/C16H16F3N5O4S/c1-29(25,26)10-5-6-12(21-9-10)24-15(23-28-13-4-2-3-7-27-13)11(8-20)14(22-24)16(17,18)19/h5-6,9,13,23H,2-4,7H2,1H3