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4AMINO-3-(PARA-CHLORO-PHENYLAMINOSULFONYLMETHYL)-5-(4'-PARA-CHLORO-PHENYL-1'H-PYRROL-3'-YL-SULFONYL-METHYL)-1,2,4-TRIAZOLE

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4AMINO-3-(PARA-CHLORO-PHENYLAMINOSULFONYLMETHYL)-5-(4'-PARA-CHLORO-PHENYL-1'H-PYRROL-3'-YL-SULFONYL-METHYL)-1,2,4-TRIAZOLE
SpectraBase Compound ID 3bJvQORmOcu
InChI InChI=1S/C20H18Cl2N6O4S2/c21-14-3-1-13(2-4-14)17-9-24-10-18(17)33(29,30)11-19-25-26-20(28(19)23)12-34(31,32)27-16-7-5-15(22)6-8-16/h1-10,24,27H,11-12,23H2
InChIKey ABRQGFSXINYEQB-UHFFFAOYSA-N
Mol Weight 541.43 g/mol
Molecular Formula C20H18Cl2N6O4S2
Exact Mass 540.020801 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6eIKUV78DF
Name 4AMINO-3-(PARA-CHLORO-PHENYLAMINOSULFONYLMETHYL)-5-(4'-PARA-CHLORO-PHENYL-1'H-PYRROL-3'-YL-SULFONYL-METHYL)-1,2,4-TRIAZOLE
Compound Number 8C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H18Cl2N6O4S2
InChI InChI=1S/C20H18Cl2N6O4S2/c21-14-3-1-13(2-4-14)17-9-24-10-18(17)33(29,30)11-19-25-26-20(28(19)23)12-34(31,32)27-16-7-5-15(22)6-8-16/h1-10,24,27H,11-12,23H2
InChIKey ABRQGFSXINYEQB-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 541.427 g/mol
Source File Reference UWIR3759