N-{5-Hydroxy-4,8a-dimethyl-6-[1-oxo-1-(4-thiomorpholinyl)-2-propanyl]-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-d][1,3]thiazol-2-yl}-1-methyl-1H-pyrrole-2-carboxamide

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Systematic / IUPAC Name: N-[5-Hydroxy-4,8a-dimethyl-6-(1-oxo-1-thiomorpholin-4-ylpropan-2-yl)-4a,5,6,7,8,9-hexahydro-4H-benzo[f][1,3]benzothiazol-2-yl]-1-methylpyrrole-2-carboxamide

ID: Reference8960

Other Names: 1H-Pyrrole-2-carboxamide, 1-methyl-N-[4,4a,5,6,7,8,8a,9-octahydro-5-hydroxy-4,8a-dimethyl-6-[1-methyl-2-oxo-2-(4-thiomorpholinyl)ethyl]naphtho[2,3-d]thiazol-2-yl]-;
NAT5-257585

Formula: C26H36N4O3S2

Spectral Data

N-{5-Hydroxy-4,8a-dimethyl-6-[1-oxo-1-(4-thiomorpholinyl)-2-propanyl]-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-d][1,3]thiazol-2-yl}-1-methyl-1H-pyrrole-2-carboxamide 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 1245
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 9/26/2019 6:47:40 AM
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Identificators

InChI InChI=1S/C26H36N4O3S2/c1-15(24(33)30-10-12-34-13-11-30)17-7-8-26(3)14-19-21(16(2)20(26)22(17)31)27-25(35-19)28-23(32)18-6-5-9-29(18)4/h5-6,9,15-17,20,22,31H,7-8,10-14H2,1-4H3,(H,27,28,32)
InChI Key VQMJEOODLCMKQP-UHFFFAOYSA-N
Canonical SMILES CC1C2C(C(CCC2(CC3=C1N=C(S3)NC(=O)C4=CC=CN4C)C)C(C)C(=O)N5CCSCC5)O
CAS
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Other Names 1H-Pyrrole-2-carboxamide, 1-methyl-N-[4,4a,5,6,7,8,8a,9-octahydro-5-hydroxy-4,8a-dimethyl-6-[1-methyl-2-oxo-2-(4-thiomorpholinyl)ethyl]naphtho[2,3-d]thiazol-2-yl]-;
NAT5-257585

In Other Databases

PubChem 4388658
ChemSpider 3590298