N-[4-(2-Anilino-2-oxoethyl)-7-hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-d][1,3]thiazol-2-yl]-4-fluorobenzamide

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

ID: Reference8800

Other Names: Naphtho[2,3-d]thiazole-4-acetamide, 2-[(4-fluorobenzoyl)amino]-4,4a,5,6,7,8,8a,9-octahydro-7-hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-N-phenyl-;
NAT8-258859

Formula: C29H32FN3O4S

Spectral Data

N-[4-(2-Anilino-2-oxoethyl)-7-hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-d][1,3]thiazol-2-yl]-4-fluorobenzamide 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 2445
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 7/29/2019 8:39:19 AM
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Identificators

InChI InChI=1S/C29H32FN3O4S/c1-28-13-12-23(35)29(2,16-34)22(28)15-21-25(20(28)14-24(36)31-19-6-4-3-5-7-19)32-27(38-21)33-26(37)17-8-10-18(30)11-9-17/h3-11,20,22-23,34-35H,12-16H2,1-2H3,(H,31,36)(H,32,33,37)
InChI Key NQHMHLNGXSYDHA-UHFFFAOYSA-N
Canonical SMILES CC12CCC(C(C1CC3=C(C2CC(=O)NC4=CC=CC=C4)N=C(S3)NC(=O)C5=CC=C(C=C5)F)(C)CO)O
CAS
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Other Names Naphtho[2,3-d]thiazole-4-acetamide, 2-[(4-fluorobenzoyl)amino]-4,4a,5,6,7,8,8a,9-octahydro-7-hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-N-phenyl-;
NAT8-258859

In Other Databases

PubChem 3852851
ChemSpider 3077954