1,4:3,6-Dianhydro-2,5-dideoxy-2-{[(4-phenoxyphenyl)carbamoyl]amino}-5-[4-(2-pyridinyl)-1H-1,2,3-triazol-1-yl]-L-iditol

enlarge

Systematic / IUPAC Name: 1-[(3S,3aR,6S,6aR)-6-(4-Pyridin-2-yltriazol-1-yl)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]-3-(4-phenoxyphenyl)urea

ID: Reference12522

Other Names: L-Iditol, 1,4:3,6-dianhydro-2,5-dideoxy-2-[[[(4-phenoxyphenyl)amino]carbonyl]amino]-5-[4-(2-pyridinyl)-1H-1,2,3-triazol-1-yl]-;
NAT6-306367

Formula: C26H24N6O4

Spectral Data

1,4:3,6-Dianhydro-2,5-dideoxy-2-{[(4-phenoxyphenyl)carbamoyl]amino}-5-[4-(2-pyridinyl)-1H-1,2,3-triazol-1-yl]-L-iditol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 1935
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 5/12/2023 1:12:46 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C26H24N6O4/c33-26(28-17-9-11-19(12-10-17)36-18-6-2-1-3-7-18)29-22-15-34-25-23(16-35-24(22)25)32-14-21(30-31-32)20-8-4-5-13-27-20/h1-14,22-25H,15-16H2,(H2,28,29,33)/t22-,23-,24+,25+/m0/s1
InChI Key WLMCUXTZEXYYHT-CXSMSNRLSA-N
Canonical SMILES C1C(C2C(O1)C(CO2)N3C=C(N=N3)C4=CC=CC=N4)NC(=O)NC5=CC=C(C=C5)OC6=CC=CC=C6
CAS
Splash
Other Names L-Iditol, 1,4:3,6-dianhydro-2,5-dideoxy-2-[[[(4-phenoxyphenyl)amino]carbonyl]amino]-5-[4-(2-pyridinyl)-1H-1,2,3-triazol-1-yl]-;
NAT6-306367

In Other Databases

ChemSpider 21384295
PubChem 23983673