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

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

ID: Reference10933

Other Names: L-Iditol, 1,4:3,6-dianhydro-2,5-dideoxy-2-[[4-(2-furanyl)-2-pyrimidinyl]amino]-5-[(4-methylbenzoyl)amino]-;
NAT6-320229

Formula: C22H22N4O4

Spectral Data

1,4:3,6-Dianhydro-2,5-dideoxy-2-{[4-(2-furyl)-2-pyrimidinyl]amino}-5-[(4-methylbenzoyl)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 1400
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 10/8/2021 9:57:05 AM
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Identificators

InChI InChI=1S/C22H22N4O4/c1-13-4-6-14(7-5-13)21(27)24-16-11-29-20-17(12-30-19(16)20)26-22-23-9-8-15(25-22)18-3-2-10-28-18/h2-10,16-17,19-20H,11-12H2,1H3,(H,24,27)(H,23,25,26)/t16-,17-,19+,20+/m0/s1
InChI Key QGEFXBCZZJDDHC-RAUXBKROSA-N
Canonical SMILES CC1=CC=C(C=C1)C(=O)NC2COC3C2OCC3NC4=NC=CC(=N4)C5=CC=CO5
CAS
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Other Names L-Iditol, 1,4:3,6-dianhydro-2,5-dideoxy-2-[[4-(2-furanyl)-2-pyrimidinyl]amino]-5-[(4-methylbenzoyl)amino]-;
NAT6-320229

In Other Databases

ChemSpider 10087293
PubChem 11912970