1,4-Anhydro-2,5-dideoxy-2-[(1H-imidazol-4-ylmethyl)amino]-5-{[(4-methylphenyl)sulfonyl]amino}-D-arabinitol

enlarge

Systematic / IUPAC Name: N-[[(2R,3S,4R)-3-Hydroxy-4-(1H-imidazol-5-ylmethylamino)oxolan-2-yl]methyl]-4-methylbenzenesulfonamide

ID: Reference13048

Other Names: D-Arabinitol, 1,4-anhydro-2,5-dideoxy-2-[(1H-imidazol-4-ylmethyl)amino]-5-[[(4-methylphenyl)sulfonyl]amino]-;
NAT19-551679

Formula: C16H22N4O4S

Spectral Data

1,4-Anhydro-2,5-dideoxy-2-[(1H-imidazol-4-ylmethyl)amino]-5-{[(4-methylphenyl)sulfonyl]amino}-D-arabinitol 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 799
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 3/6/2024 11:32:54 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C16H22N4O4S/c1-11-2-4-13(5-3-11)25(22,23)20-8-15-16(21)14(9-24-15)18-7-12-6-17-10-19-12/h2-6,10,14-16,18,20-21H,7-9H2,1H3,(H,17,19)/t14-,15-,16+/m1/s1
InChI Key WDGYZUFJVHZGEK-OAGGEKHMSA-N
Canonical SMILES CC1=CC=C(C=C1)S(=O)(=O)NCC2C(C(CO2)NCC3=CN=CN3)O
CAS
Splash
Other Names D-Arabinitol, 1,4-anhydro-2,5-dideoxy-2-[(1H-imidazol-4-ylmethyl)amino]-5-[[(4-methylphenyl)sulfonyl]amino]-;
NAT19-551679

In Other Databases

ChemSpider 29858630
PubChem 75536715