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2-(PARA-CHLORO-PHENYLAMINOSULFONYLMETHYL)-5-(4'-PARA-CHLORO-PHENYL-1'H-PYRROL-3'-YL-SULFONYL-METHYL)-1,3,4-THIADIAZOLE
SpectraBase Compound ID EZavP0XoOfM
InChI InChI=1S/C20H16Cl2N4O4S3/c21-14-3-1-13(2-4-14)17-9-23-10-18(17)32(27,28)11-19-24-25-20(31-19)12-33(29,30)26-16-7-5-15(22)6-8-16/h1-10,23,26H,11-12H2
InChIKey JBADMRALAOHROA-UHFFFAOYSA-N
Mol Weight 543.46 g/mol
Molecular Formula C20H16Cl2N4O4S3
Exact Mass 541.971074 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EGjatJiaOpj
Name 2-(PARA-CHLORO-PHENYLAMINOSULFONYLMETHYL)-5-(4'-PARA-CHLORO-PHENYL-1'H-PYRROL-3'-YL-SULFONYL-METHYL)-1,3,4-THIADIAZOLE
Compound Number 7C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H16Cl2N4O4S3
InChI InChI=1S/C20H16Cl2N4O4S3/c21-14-3-1-13(2-4-14)17-9-23-10-18(17)32(27,28)11-19-24-25-20(31-19)12-33(29,30)26-16-7-5-15(22)6-8-16/h1-10,23,26H,11-12H2
InChIKey JBADMRALAOHROA-UHFFFAOYSA-N
Literature Reference Author A.PADMAJA,A.MURALIKRISHNA,C.RAJASEKHAR,V.PADMAVATHI
Literature Reference Citation CHEM.PHARM.BULL.,59,1509(2011)
Literature Reference DOI 10.1248/cpb.59.1509
Molecular Weight 543.457 g/mol
Source File Reference UWIR3756