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

enlarge

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

ID: Reference9023

Other Names: Benzamide, 4-fluoro-N-[4,4a,5,6,7,8,8a,9-octahydro-7-hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-4-[2-oxo-2-(1-piperidinyl)ethyl]naphtho[2,3-d]thiazol-2-yl]-;
NAT8-264156

Formula: C28H36FN3O4S

Spectral Data

4-Fluoro-N-{7-hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-4-[2-oxo-2-(1-piperidinyl)ethyl]-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 1336
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 10/21/2019 6:50:49 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C28H36FN3O4S/c1-27-11-10-22(34)28(2,16-33)21(27)15-20-24(19(27)14-23(35)32-12-4-3-5-13-32)30-26(37-20)31-25(36)17-6-8-18(29)9-7-17/h6-9,19,21-22,33-34H,3-5,10-16H2,1-2H3,(H,30,31,36)
InChI Key SESYXAVIDSXZEW-UHFFFAOYSA-N
Canonical SMILES CC12CCC(C(C1CC3=C(C2CC(=O)N4CCCCC4)N=C(S3)NC(=O)C5=CC=C(C=C5)F)(C)CO)O
CAS
Splash
Other Names Benzamide, 4-fluoro-N-[4,4a,5,6,7,8,8a,9-octahydro-7-hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-4-[2-oxo-2-(1-piperidinyl)ethyl]naphtho[2,3-d]thiazol-2-yl]-;
NAT8-264156

In Other Databases

ChemSpider 2557835
PubChem 3309853