3-Fluoro-N-{7-hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-4-[2-(4-morpholinyl)-2-oxoethyl]-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-d][1,3]thiazol-2-yl}benzamide

enlarge

Systematic / IUPAC Name: 3-Fluoro-N-[7-hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-4-(2-morpholin-4-yl-2-oxoethyl)-4,5,6,7,8a,9-hexahydrobenzo[f][1,3]benzothiazol-2-yl]benzamide

ID: Reference8941

Other Names: Benzamide, 3-fluoro-N-[4,4a,5,6,7,8,8a,9-octahydro-7-hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-4-[2-(4-morpholinyl)-2-oxoethyl]naphtho[2,3-d]thiazol-2-yl]-;
NAT8-264313

Formula: C27H34FN3O5S

Spectral Data

3-Fluoro-N-{7-hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-4-[2-(4-morpholinyl)-2-oxoethyl]-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-d][1,3]thiazol-2-yl}benzamide 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 FAIMS
No. of Spectral Trees 1
No. of Spectra 1308
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 9/20/2019 7:58:44 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C27H34FN3O5S/c1-26-7-6-21(33)27(2,15-32)20(26)14-19-23(18(26)13-22(34)31-8-10-36-11-9-31)29-25(37-19)30-24(35)16-4-3-5-17(28)12-16/h3-5,12,18,20-21,32-33H,6-11,13-15H2,1-2H3,(H,29,30,35)
InChI Key AYQLGYDTZLUOHI-UHFFFAOYSA-N
Canonical SMILES CC12CCC(C(C1CC3=C(C2CC(=O)N4CCOCC4)N=C(S3)NC(=O)C5=CC(=CC=C5)F)(C)CO)O
CAS
Splash
Other Names Benzamide, 3-fluoro-N-[4,4a,5,6,7,8,8a,9-octahydro-7-hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-4-[2-(4-morpholinyl)-2-oxoethyl]naphtho[2,3-d]thiazol-2-yl]-;
NAT8-264313

In Other Databases

ChemSpider 3085098
PubChem 3860129