2-[7-Hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-2-(3-thienyl)-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-d][1,3]thiazol-4-yl]-N-(3-hydroxyphenyl)acetamide

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Systematic / IUPAC Name: 2-[7-Hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-2-thiophen-3-yl-4,5,6,7,8a,9-hexahydrobenzo[f][1,3]benzothiazol-4-yl]-N-(3-hydroxyphenyl)acetamide

ID: Reference9301

Other Names: Naphtho[2,3-d]thiazole-4-acetamide, 4,4a,5,6,7,8,8a,9-octahydro-7-hydroxy-8-(hydroxymethyl)-N-(3-hydroxyphenyl)-4a,8-dimethyl-2-(3-thienyl)-;
NAT8-264676

Formula: C26H30N2O4S2

Spectral Data

2-[7-Hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-2-(3-thienyl)-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-d][1,3]thiazol-4-yl]-N-(3-hydroxyphenyl)acetamide 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 3555
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6, MS7
Ionization Methods NSI
Analyzers FT
Last Modification 1/24/2020 9:43:16 AM
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Identificators

InChI InChI=1S/C26H30N2O4S2/c1-25-8-6-21(31)26(2,14-29)20(25)12-19-23(28-24(34-19)15-7-9-33-13-15)18(25)11-22(32)27-16-4-3-5-17(30)10-16/h3-5,7,9-10,13,18,20-21,29-31H,6,8,11-12,14H2,1-2H3,(H,27,32)
InChI Key ZMTYTWDBCLFMQC-UHFFFAOYSA-N
Canonical SMILES CC12CCC(C(C1CC3=C(C2CC(=O)NC4=CC(=CC=C4)O)N=C(S3)C5=CSC=C5)(C)CO)O
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Other Names Naphtho[2,3-d]thiazole-4-acetamide, 4,4a,5,6,7,8,8a,9-octahydro-7-hydroxy-8-(hydroxymethyl)-N-(3-hydroxyphenyl)-4a,8-dimethyl-2-(3-thienyl)-;
NAT8-264676

In Other Databases

ChemSpider 2900863
PubChem 3667856