2-{[(4-Acetylphenyl)carbamoyl]amino}-1,4:3,6-dianhydro-2,5-dideoxy-5-{5-[3-(dimethylamino)phenoxy]-1H-tetrazol-1-yl}-L-iditol

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Systematic / IUPAC Name: 1-[(3S,3aR,6S,6aR)-6-[5-[3-(Dimethylamino)phenoxy]tetrazol-1-yl]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]-3-(4-acetylphenyl)urea

ID: Reference10503

Other Names: L-Iditol, 2-[[[(4-acetylphenyl)amino]carbonyl]amino]-1,4:3,6-dianhydro-2,5-dideoxy-5-[5-[3-(dimethylamino)phenoxy]-1H-tetrazol-1-yl]-;
NAT6-298313

Formula: C24H27N7O5

Spectral Data

2-{[(4-Acetylphenyl)carbamoyl]amino}-1,4:3,6-dianhydro-2,5-dideoxy-5-{5-[3-(dimethylamino)phenoxy]-1H-tetrazol-1-yl}-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 2
No. of Spectra 4976
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 5/28/2021 8:12:40 AM
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Identificators

InChI InChI=1S/C24H27N7O5/c1-14(32)15-7-9-16(10-8-15)25-23(33)26-19-12-34-22-20(13-35-21(19)22)31-24(27-28-29-31)36-18-6-4-5-17(11-18)30(2)3/h4-11,19-22H,12-13H2,1-3H3,(H2,25,26,33)/t19-,20-,21+,22+/m0/s1
InChI Key HKZXBYWRELRCEV-FNAHDJPLSA-N
Canonical SMILES CC(=O)C1=CC=C(C=C1)NC(=O)NC2COC3C2OCC3N4C(=NN=N4)OC5=CC=CC(=C5)N(C)C
CAS
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Other Names L-Iditol, 2-[[[(4-acetylphenyl)amino]carbonyl]amino]-1,4:3,6-dianhydro-2,5-dideoxy-5-[5-[3-(dimethylamino)phenoxy]-1H-tetrazol-1-yl]-;
NAT6-298313

In Other Databases

PubChem 11879575
ChemSpider 10053903