1,4:3,6-Dianhydro-2-deoxy-2-{5-[(2-furylmethyl)sulfanyl]-1H-tetrazol-1-yl}-5-O-[(3-methoxyphenyl)carbamoyl]-D-glucitol

enlarge

Systematic / IUPAC Name: [(3S,3aR,6R,6aS)-3-[5-(Furan-2-ylmethylsulfanyl)tetrazol-1-yl]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] N-(3-methoxyphenyl)carbamate

ID: Reference12414

Other Names: D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-2-[5-[(2-furanylmethyl)thio]-1H-tetrazol-1-yl]-, 5-[(3-methoxyphenyl)carbamate];
NAT6-296050

Formula: C20H21N5O6S

Spectral Data

1,4:3,6-Dianhydro-2-deoxy-2-{5-[(2-furylmethyl)sulfanyl]-1H-tetrazol-1-yl}-5-O-[(3-methoxyphenyl)carbamoyl]-D-glucitol 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 2437
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 3/31/2023 2:29:08 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C20H21N5O6S/c1-27-13-5-2-4-12(8-13)21-20(26)31-16-10-30-17-15(9-29-18(16)17)25-19(22-23-24-25)32-11-14-6-3-7-28-14/h2-8,15-18H,9-11H2,1H3,(H,21,26)/t15-,16+,17+,18+/m0/s1
InChI Key ZRBBMUOENUSIFA-BSDSXHPESA-N
Canonical SMILES COC1=CC=CC(=C1)NC(=O)OC2COC3C2OCC3N4C(=NN=N4)SCC5=CC=CO5
CAS
Splash
Other Names D-Glucitol, 1,4:3,6-dianhydro-2-deoxy-2-[5-[(2-furanylmethyl)thio]-1H-tetrazol-1-yl]-, 5-[(3-methoxyphenyl)carbamate];
NAT6-296050

In Other Databases

PubChem 11886015
ChemSpider 10060338