Methyl (6S)-3-(4-methoxybenzyl)-5-(2-thienylcarbonyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxylate

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Systematic / IUPAC Name: Methyl (6S)-3-[(4-methoxyphenyl)methyl]-5-(thiophene-2-carbonyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxylate

ID: Reference9451

Other Names: 3H-Imidazo[4,5-c]pyridine-6-carboxylic acid, 4,5,6,7-tetrahydro-3-[(4-methoxyphenyl)methyl]-5-(2-thienylcarbonyl)-, methyl ester, (6S)-;
NAT22-373226

Formula: C21H21N3O4S

Spectral Data

Methyl (6S)-3-(4-methoxybenzyl)-5-(2-thienylcarbonyl)-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 2012
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 3/5/2020 11:50:58 AM
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Identificators

InChI InChI=1S/C21H21N3O4S/c1-27-15-7-5-14(6-8-15)11-23-13-22-16-10-17(21(26)28-2)24(12-18(16)23)20(25)19-4-3-9-29-19/h3-9,13,17H,10-12H2,1-2H3/t17-/m0/s1
InChI Key YEVLBTAVSAAFDW-KRWDZBQOSA-N
Canonical SMILES COC1=CC=C(C=C1)CN2C=NC3=C2CN(C(C3)C(=O)OC)C(=O)C4=CC=CS4
CAS
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Other Names 3H-Imidazo[4,5-c]pyridine-6-carboxylic acid, 4,5,6,7-tetrahydro-3-[(4-methoxyphenyl)methyl]-5-(2-thienylcarbonyl)-, methyl ester, (6S)-;
NAT22-373226

In Other Databases

ChemSpider 21388392
PubChem 25338987