N,N-Bis(2-pyridinylmethyl)-1-benzothiophene-2-carboxamide

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Systematic / IUPAC Name: N,N-Bis(2-pyridinylmethyl)-1-benzothiophene-2-carboxamide

ID: Reference4622

Other Names: Benzo[b]thiophene-2-carboxamide, N,N-bis(2-pyridinylmethyl)-

Formula: C21H17N3OS

Spectral Data

N,N-Bis(2-pyridinylmethyl)-1-benzothiophene-2-carboxamide 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 Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 117
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 4/25/2016 9:38:38 AM
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Identificators

InChI InChI=1S/C21H17N3OS/c25-21(20-13-16-7-1-2-10-19(16)26-20)24(14-17-8-3-5-11-22-17)15-18-9-4-6-12-23-18/h1-13H,14-15H2
InChI Key PVXFFZVSGCCTOI-UHFFFAOYSA-N
Canonical SMILES C1=CC=C2C(=C1)C=C(S2)C(=O)N(CC3=CC=CC=N3)CC4=CC=CC=N4
CAS
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Other Names Benzo[b]thiophene-2-carboxamide, N,N-bis(2-pyridinylmethyl)-

In Other Databases

ChemSpider 2088965
PubChem 2810549