2-{5-Hydroxy-4,8a-dimethyl-2-[(phenylsulfanyl)methyl]-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-d][1,3]thiazol-6-yl}-N-[2-(4-morpholinyl)ethyl]propanamide

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Systematic / IUPAC Name: 2-[5-Hydroxy-4,8a-dimethyl-2-(phenylsulfanylmethyl)-4a,5,6,7,8,9-hexahydro-4H-benzo[f][1,3]benzothiazol-6-yl]-N-(2-morpholin-4-ylethyl)propanamide

ID: Reference9198

Other Names: Naphtho[2,3-d]thiazole-6-acetamide, 4,4a,5,6,7,8,8a,9-octahydro-5-hydroxy-α,4,8a-trimethyl-N-[2-(4-morpholinyl)ethyl]-2-[(phenylthio)methyl]-;
NAT5-257114

Formula: C29H41N3O3S2

Spectral Data

2-{5-Hydroxy-4,8a-dimethyl-2-[(phenylsulfanyl)methyl]-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-d][1,3]thiazol-6-yl}-N-[2-(4-morpholinyl)ethyl]propanamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP FAIMS
No. of Spectral Trees 1
No. of Spectra 1244
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 12/9/2019 10:05:03 AM
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Identificators

InChI InChI=1S/C29H41N3O3S2/c1-19(28(34)30-11-12-32-13-15-35-16-14-32)22-9-10-29(3)17-23-26(20(2)25(29)27(22)33)31-24(37-23)18-36-21-7-5-4-6-8-21/h4-8,19-20,22,25,27,33H,9-18H2,1-3H3,(H,30,34)
InChI Key DXXLDFGKLGFPBE-UHFFFAOYSA-N
Canonical SMILES CC1C2C(C(CCC2(CC3=C1N=C(S3)CSC4=CC=CC=C4)C)C(C)C(=O)NCCN5CCOCC5)O
CAS
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Other Names Naphtho[2,3-d]thiazole-6-acetamide, 4,4a,5,6,7,8,8a,9-octahydro-5-hydroxy-α,4,8a-trimethyl-N-[2-(4-morpholinyl)ethyl]-2-[(phenylthio)methyl]-;
NAT5-257114

In Other Databases

PubChem 3691930
ChemSpider 2924089