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1-methyl-3-{{p-[5-(2-thienyl)-3-(trifluoromethyl)pyrazol-1-yl]phenyl}sulfonyl}-2-thiourea
SpectraBase Compound ID 8US3mlT1wt5
InChI InChI=1S/C16H13F3N4O2S3/c1-20-15(26)22-28(24,25)11-6-4-10(5-7-11)23-12(13-3-2-8-27-13)9-14(21-23)16(17,18)19/h2-9H,1H3,(H2,20,22,26)
InChIKey XHMPOTFPROHCRR-UHFFFAOYSA-N
Mol Weight 446.48 g/mol
Molecular Formula C16H13F3N4O2S3
Exact Mass 446.015274 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 3mGqEsIG2gb
Name 1-METHYL-3-{{p-[5-(2-THIENYL)-3-(TRIFLUOROMETHYL)PYRAZOL-1-YL]PHENYL}SULFONYL}-2-THIOUREA
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13F3N4O2S3
InChI InChI=1S/C16H13F3N4O2S3/c1-20-15(26)22-28(24,25)11-6-4-10(5-7-11)23-12(13-3-2-8-27-13)9-14(21-23)16(17,18)19/h2-9H,1H3,(H2,20,22,26)
InChIKey XHMPOTFPROHCRR-UHFFFAOYSA-N
Melting Point 172-173C
Molecular Weight 446.485992
Synonyms UREA, 1-METHYL-3-//P-/5-/2-THIEN- YL/-3-/TRIFLUOROMETHYL/PYRAZOL-1-YL/- PHENYL/SULFONYL/-2-THIO-,
Technique KBr WAFER