1,4:3,6-Dianhydro-2,5-dideoxy-2-{[4-(dimethylamino)benzoyl]amino}-5-{[4-(2-methoxyphenyl)-2-pyrimidinyl]amino}-L-iditol

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Systematic / IUPAC Name: N-[(3S,3aR,6S,6aR)-3-[[4-(2-Methoxyphenyl)pyrimidin-2-yl]amino]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]-4-(dimethylamino)benzamide

ID: Reference12513

Other Names: L-Iditol, 1,4:3,6-dianhydro-2,5-dideoxy-2-[[4-(dimethylamino)benzoyl]amino]-5-[[4-(2-methoxyphenyl)-2-pyrimidinyl]amino]-;
NAT6-321934

Formula: C26H29N5O4

Spectral Data

1,4:3,6-Dianhydro-2,5-dideoxy-2-{[4-(dimethylamino)benzoyl]amino}-5-{[4-(2-methoxyphenyl)-2-pyrimidinyl]amino}-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 2146
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 5/15/2023 8:23:17 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C26H29N5O4/c1-31(2)17-10-8-16(9-11-17)25(32)28-20-14-34-24-21(15-35-23(20)24)30-26-27-13-12-19(29-26)18-6-4-5-7-22(18)33-3/h4-13,20-21,23-24H,14-15H2,1-3H3,(H,28,32)(H,27,29,30)/t20-,21-,23+,24+/m0/s1
InChI Key FLZYSNASAYKGES-NEUULRRLSA-N
Canonical SMILES CN(C)C1=CC=C(C=C1)C(=O)NC2COC3C2OCC3NC4=NC=CC(=N4)C5=CC=CC=C5OC
CAS
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Other Names L-Iditol, 1,4:3,6-dianhydro-2,5-dideoxy-2-[[4-(dimethylamino)benzoyl]amino]-5-[[4-(2-methoxyphenyl)-2-pyrimidinyl]amino]-;
NAT6-321934

In Other Databases

ChemSpider 10086100
PubChem 11911777