1,4:3,6-Dianhydro-2,5-dideoxy-2-{5-[3-(4-morpholinyl)phenoxy]-1H-tetrazol-1-yl}-5-[(2-thienylsulfonyl)amino]-L-iditol

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Systematic / IUPAC Name: N-[(3S,3aR,6S,6aR)-6-[5-(3-Morpholin-4-ylphenoxy)tetrazol-1-yl]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]thiophene-2-sulfonamide

ID: Reference12424

Other Names: L-Iditol, 1,4:3,6-dianhydro-2,5-dideoxy-2-[5-[3-(4-morpholinyl)phenoxy]-1H-tetrazol-1-yl]-5-[(2-thienylsulfonyl)amino]-;
NAT6-298485

Formula: C21H24N6O6S2

Spectral Data

1,4:3,6-Dianhydro-2,5-dideoxy-2-{5-[3-(4-morpholinyl)phenoxy]-1H-tetrazol-1-yl}-5-[(2-thienylsulfonyl)amino]-L-iditol 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 2565
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 3/31/2023 3:31:52 PM
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Identificators

InChI InChI=1S/C21H24N6O6S2/c28-35(29,18-5-2-10-34-18)23-16-12-31-20-17(13-32-19(16)20)27-21(22-24-25-27)33-15-4-1-3-14(11-15)26-6-8-30-9-7-26/h1-5,10-11,16-17,19-20,23H,6-9,12-13H2/t16-,17-,19+,20+/m0/s1
InChI Key OVGAWTLIYAAUCQ-RAUXBKROSA-N
Canonical SMILES C1COCCN1C2=CC(=CC=C2)OC3=NN=NN3C4COC5C4OCC5NS(=O)(=O)C6=CC=CS6
CAS
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Other Names L-Iditol, 1,4:3,6-dianhydro-2,5-dideoxy-2-[5-[3-(4-morpholinyl)phenoxy]-1H-tetrazol-1-yl]-5-[(2-thienylsulfonyl)amino]-;
NAT6-298485

In Other Databases

PubChem 11879618
ChemSpider 10053946