N-[4-({(1R,9R)-3-[4-(Methylsulfanyl)phenyl]-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl}sulfonyl)phenyl]acetamide

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Systematic / IUPAC Name: N-[4-[[(1R,9R)-3-(4-Methylsulfanylphenyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl]sulfonyl]phenyl]acetamide

ID: Reference12865

Other Names: NAT11-288484

Formula: C26H27N3O4S2

Spectral Data

N-[4-({(1R,9R)-3-[4-(Methylsulfanyl)phenyl]-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl}sulfonyl)phenyl]acetamide 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 1
No. of Spectra 2610
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 11/7/2023 12:36:22 PM
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Identificators

InChI InChI=1S/C26H27N3O4S2/c1-17(30)27-21-5-9-23(10-6-21)35(32,33)28-14-18-13-20(16-28)26-24(11-12-25(31)29(26)15-18)19-3-7-22(34-2)8-4-19/h3-12,18,20H,13-16H2,1-2H3,(H,27,30)/t18-,20+/m0/s1
InChI Key UYSVMOHKAODFMA-AZUAARDMSA-N
Canonical SMILES CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CC3CC(C2)C4=C(C=CC(=O)N4C3)C5=CC=C(C=C5)SC
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Other Names NAT11-288484

In Other Databases

PubChem 7144237
ChemSpider 5484976