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

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

ID: Reference13091

Other Names: L-Iditol, 1,4:3,6-dianhydro-2,5-dideoxy-2-[[[(4-methoxyphenyl)amino]carbonyl]amino]-5-[5-[4-(1H-1,2,4-triazol-1-yl)phenoxy]-1H-tetrazol-1-yl]-;
NAT6-298552

Formula: C23H23N9O5

Spectral Data

1,4:3,6-Dianhydro-2,5-dideoxy-2-{[(4-methoxyphenyl)carbamoyl]amino}-5-{5-[4-(1H-1,2,4-triazol-1-yl)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.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 2734
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 4/5/2024 12:50:19 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C23H23N9O5/c1-34-16-6-2-14(3-7-16)26-22(33)27-18-10-35-21-19(11-36-20(18)21)32-23(28-29-30-32)37-17-8-4-15(5-9-17)31-13-24-12-25-31/h2-9,12-13,18-21H,10-11H2,1H3,(H2,26,27,33)/t18-,19-,20+,21+/m0/s1
InChI Key MNYHEHIMXDBZAN-UWHLTILDSA-N
Canonical SMILES COC1=CC=C(C=C1)NC(=O)NC2COC3C2OCC3N4C(=NN=N4)OC5=CC=C(C=C5)N6C=NC=N6
CAS
Splash
Other Names L-Iditol, 1,4:3,6-dianhydro-2,5-dideoxy-2-[[[(4-methoxyphenyl)amino]carbonyl]amino]-5-[5-[4-(1H-1,2,4-triazol-1-yl)phenoxy]-1H-tetrazol-1-yl]-;
NAT6-298552

In Other Databases

PubChem 11886267
ChemSpider 10060590