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

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Systematic / IUPAC Name: 1-[(3S,3aR,6S,6aR)-3-[[4-[4-(Dimethylamino)phenyl]pyrimidin-2-yl]amino]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]-3-naphthalen-1-ylurea

ID: Reference12644

Other Names: L-Iditol, 1,4:3,6-dianhydro-2,5-dideoxy-2-[[4-[4-(dimethylamino)phenyl]-2-pyrimidinyl]amino]-5-[[(1-naphthalenylamino)carbonyl]amino]-;
NAT6-319209

Formula: C29H30N6O3

Spectral Data

1,4:3,6-Dianhydro-2,5-dideoxy-2-({4-[4-(dimethylamino)phenyl]-2-pyrimidinyl}amino)-5-[(1-naphthylcarbamoyl)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 1928
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 7/10/2023 1:13:25 PM
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Identificators

InChI InChI=1S/C29H30N6O3/c1-35(2)20-12-10-19(11-13-20)22-14-15-30-28(31-22)32-24-16-37-27-25(17-38-26(24)27)34-29(36)33-23-9-5-7-18-6-3-4-8-21(18)23/h3-15,24-27H,16-17H2,1-2H3,(H,30,31,32)(H2,33,34,36)/t24-,25-,26+,27+/m0/s1
InChI Key DGQXKLNZZQUOCF-GWMMUDDPSA-N
Canonical SMILES CN(C)C1=CC=C(C=C1)C2=NC(=NC=C2)NC3COC4C3OCC4NC(=O)NC5=CC=CC6=CC=CC=C65
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Other Names L-Iditol, 1,4:3,6-dianhydro-2,5-dideoxy-2-[[4-[4-(dimethylamino)phenyl]-2-pyrimidinyl]amino]-5-[[(1-naphthalenylamino)carbonyl]amino]-;
NAT6-319209

In Other Databases

ChemSpider 21388506
PubChem 44716813