Methyl (6S)-5-[(4-acetylphenyl)sulfonyl]-3-(4-chlorobenzyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxylate

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Systematic / IUPAC Name: Methyl (6S)-5-(4-acetylphenyl)sulfonyl-3-[(4-chlorophenyl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxylate

ID: Reference9413

Other Names: 3H-Imidazo[4,5-c]pyridine-6-carboxylic acid, 5-[(4-acetylphenyl)sulfonyl]-3-[(4-chlorophenyl)methyl]-4,5,6,7-tetrahydro-, methyl ester, (6S)-;
NAT22-373569

Formula: C23H22ClN3O5S

Spectral Data

Methyl (6S)-5-[(4-acetylphenyl)sulfonyl]-3-(4-chlorobenzyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxylate mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 2
No. of Spectra 4556
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6, MS7
Ionization Methods NSI
Analyzers FT
Last Modification 2/28/2020 11:16:05 AM
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Identificators

InChI InChI=1S/C23H22ClN3O5S/c1-15(28)17-5-9-19(10-6-17)33(30,31)27-13-22-20(11-21(27)23(29)32-2)25-14-26(22)12-16-3-7-18(24)8-4-16/h3-10,14,21H,11-13H2,1-2H3/t21-/m0/s1
InChI Key SDMNZFJCLXANBU-NRFANRHFSA-N
Canonical SMILES CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CC3=C(CC2C(=O)OC)N=CN3CC4=CC=C(C=C4)Cl
CAS
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Other Names 3H-Imidazo[4,5-c]pyridine-6-carboxylic acid, 5-[(4-acetylphenyl)sulfonyl]-3-[(4-chlorophenyl)methyl]-4,5,6,7-tetrahydro-, methyl ester, (6S)-;
NAT22-373569

In Other Databases

PubChem 26745474
ChemSpider 21388407