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

Systemtic Name: 1-(5-methylsulfonylpyridin-2-yl)-5-(phenylmethoxyamino)-3-(trifluoromethyl)pyrazole-4-carbonitrile Openeye Name: 5-(benzyloxyamino)-1-(5-methylsulfonyl-2-pyridyl)-3-(trifluoromethyl)pyrazole-4-carbonitrile CAS Name: 1-(5-methylsulfonyl-2-pyridinyl)-5-(phenylmethoxyamino)-3-(trifluoromethyl)-4-pyrazolecarbonitrile IUPAC Name: 1-(5-methylsulfonylpyridin-2-yl)-5-(phenylmethoxyamino)-3-(trifluoromethyl)pyrazole-4-carbonitrile Traditional Name: 5-(benzoxyamino)-1-(5-mesyl-2-pyridyl)-3-(trifluoromethyl)pyrazole-4-carbonitrile Formula: C18H14F3N5O3S MolecularWeight: 437.39567

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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)NOCC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=CN=C(C=C1)N2C(=C(C(=N2)C(F)(F)F)C#N)NOCC3=CC=CC=C3

InChI

InChI=1S/C18H14F3N5O3S/c1-30(27,28)13-7-8-15(23-10-13)26-17(14(9-22)16(24-26)18(19,20)21)25-29-11-12-5-3-2-4-6-12/h2-8,10,25H,11H2,1H3