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

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

ID: Reference9356

Other Names: 3H-Imidazo[4,5-c]pyridine-6-carboxylic acid, 3-[(4-chlorophenyl)methyl]-5-[(4-cyanophenyl)sulfonyl]-4,5,6,7-tetrahydro-, methyl ester, (6S)-;
NAT22-373573

Formula: C22H19ClN4O4S

Spectral Data

Methyl (6S)-3-(4-chlorobenzyl)-5-[(4-cyanophenyl)sulfonyl]-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 1707
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 2/5/2020 2:25:43 PM
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Identificators

InChI InChI=1S/C22H19ClN4O4S/c1-31-22(28)20-10-19-21(26(14-25-19)12-16-2-6-17(23)7-3-16)13-27(20)32(29,30)18-8-4-15(11-24)5-9-18/h2-9,14,20H,10,12-13H2,1H3/t20-/m0/s1
InChI Key IQCZDRDEUGQGJB-FQEVSTJZSA-N
Canonical SMILES COC(=O)C1CC2=C(CN1S(=O)(=O)C3=CC=C(C=C3)C#N)N(C=N2)CC4=CC=C(C=C4)Cl
CAS
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Other Names 3H-Imidazo[4,5-c]pyridine-6-carboxylic acid, 3-[(4-chlorophenyl)methyl]-5-[(4-cyanophenyl)sulfonyl]-4,5,6,7-tetrahydro-, methyl ester, (6S)-;
NAT22-373573

In Other Databases

ChemSpider 21388409
PubChem 26745476