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3-[(p-CHLOROPHENYL)CARBAMOYL]-N-{{p-[5-(2-THIENYL)-3-(TRIFLUOROMETHYL)PYRAZOL-1-YL]PHENYL}SULFONYL}THIOCARBAZIMIDIC ACID, METHYL ESTER

View entire compound with spectra: 1 FTIR

3-[(p-CHLOROPHENYL)CARBAMOYL]-N-{{p-[5-(2-THIENYL)-3-(TRIFLUOROMETHYL)PYRAZOL-1-YL]PHENYL}SULFONYL}THIOCARBAZIMIDIC ACID, METHYL ESTER
SpectraBase Compound ID DsreiS1Ts2K
InChI InChI=1S/C23H18ClF3N6O3S3/c1-37-22(30-29-21(34)28-15-6-4-14(24)5-7-15)32-39(35,36)17-10-8-16(9-11-17)33-18(19-3-2-12-38-19)13-20(31-33)23(25,26)27/h2-13H,1H3,(H,30,32)(H2,28,29,34)
InChIKey BFMBPEYCEFCPNG-UHFFFAOYSA-N
Mol Weight 615.06 g/mol
Molecular Formula C23H18ClF3N6O3S3
Exact Mass 614.024314 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID ACDGOZcWEL1
Name 3-[(p-CHLOROPHENYL)CARBAMOYL]-N-{{p-[5-(2-THIENYL)-3-(TRIFLUOROMETHYL)PYRAZOL-1-YL]PHENYL}SULFONYL}THIOCARBAZIMIDIC ACID, METHYL ESTER
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H18ClF3N6O3S3
InChI InChI=1S/C23H18ClF3N6O3S3/c1-37-22(30-29-21(34)28-15-6-4-14(24)5-7-15)32-39(35,36)17-10-8-16(9-11-17)33-18(19-3-2-12-38-19)13-20(31-33)23(25,26)27/h2-13H,1H3,(H,30,32)(H2,28,29,34)
InChIKey BFMBPEYCEFCPNG-UHFFFAOYSA-N
Melting Point 223-224C
Molecular Weight 615.065979
Synonyms CARBAZIMIDIC ACID, 3-//P-CHLORO- PHENYL/CARBAMOYL/-N-//P-/5-/2-THIENYL/- 3-/TRIFLUOROMETHYL/PYRAZOL-1-YL/- PHENYL/SULFONYL/THIO-, METHYL ESTER
Technique KBr WAFER