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N-(3-Methoxy-2-pyrazinyl)-4-[(([3,3,3-trifluoro-1-(1,1,2,2,2-pentafluoroethyl)-2-(trifluoromethyl)-1-propenyl]amino)carbothioyl)amino]benzenesulfonamide

View entire compound with spectra: 1 MS (GC)

N-(3-Methoxy-2-pyrazinyl)-4-[(([3,3,3-trifluoro-1-(1,1,2,2,2-pentafluoroethyl)-2-(trifluoromethyl)-1-propenyl]amino)carbothioyl)amino]benzenesulfonamide
SpectraBase Compound ID 7Bbc4XRZDLt
InChI InChI=1S/C18H12F11N5O3S2/c1-37-13-12(30-6-7-31-13)34-39(35,36)9-4-2-8(3-5-9)32-14(38)33-11(15(19,20)18(27,28)29)10(16(21,22)23)17(24,25)26/h2-7,10H,1H3,(H,30,34)(H,32,38)/b33-11+
InChIKey SROONEPSSHBKDL-RRDBNTQTSA-N
Mol Weight 619.43 g/mol
Molecular Formula C18H12F11N5O3S2
Exact Mass 619.020591 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8gxgDvLzO5p
Name N-(3-Methoxy-2-pyrazinyl)-4-[(([3,3,3-trifluoro-1-(1,1,2,2,2-pentafluoroethyl)-2-(trifluoromethyl)-1-propenyl]amino)carbothioyl)amino]benzenesulfonamide
CAS Registry Number 306766-78-9
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H12F11N5O3S2
InChI InChI=1S/C18H12F11N5O3S2/c1-37-13-12(30-6-7-31-13)34-39(35,36)9-4-2-8(3-5-9)32-14(38)33-11(15(19,20)18(27,28)29)10(16(21,22)23)17(24,25)26/h2-7,10H,1H3,(H,30,34)(H,32,38)/b33-11+
InChIKey SROONEPSSHBKDL-RRDBNTQTSA-N
Molecular Weight 619.428 g/mol
SMILES N(S(c1ccc(NC(\N=C\(C(C(F)(F)F)(F)F)C(C(F)(F)F)C(F)(F)F)=S)cc1)(=O)=O)c1c(nccn1)OC
SPLASH splash10-0a4m-9420000000-70aa16f81a45b2c05186
Wiley ID 1467350