5-(1,3-dioxolan-2-ylmethylamino)-1-(5-methylsulfonylpyridin-2-yl)-3-(trifluoromethyl)pyrazole-4-carbonitrile

Systemtic Name: 5-(1,3-dioxolan-2-ylmethylamino)-1-(5-methylsulfonylpyridin-2-yl)-3-(trifluoromethyl)pyrazole-4-carbonitrile Openeye Name: 5-(1,3-dioxolan-2-ylmethylamino)-1-(5-methylsulfonyl-2-pyridyl)-3-(trifluoromethyl)pyrazole-4-carbonitrile CAS Name: 5-(1,3-dioxolan-2-ylmethylamino)-1-(5-methylsulfonyl-2-pyridinyl)-3-(trifluoromethyl)-4-pyrazolecarbonitrile IUPAC Name: 5-(1,3-dioxolan-2-ylmethylamino)-1-(5-methylsulfonylpyridin-2-yl)-3-(trifluoromethyl)pyrazole-4-carbonitrile Traditional Name: 5-(1,3-dioxolan-2-ylmethylamino)-1-(5-mesyl-2-pyridyl)-3-(trifluoromethyl)pyrazole-4-carbonitrile Formula: C15H14F3N5O4S MolecularWeight: 417.36297

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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)NCC3OCCO3

Isomeric SMILES

CS(=O)(=O)C1=CN=C(C=C1)N2C(=C(C(=N2)C(F)(F)F)C#N)NCC3OCCO3

InChI

InChI=1S/C15H14F3N5O4S/c1-28(24,25)9-2-3-11(20-7-9)23-14(21-8-12-26-4-5-27-12)10(6-19)13(22-23)15(16,17)18/h2-3,7,12,21H,4-5,8H2,1H3