Methyl 3-[({[2-(methoxycarbonyl)-3-thienyl]amino}carbothioyl)amino]thiophene-2-carboxylate

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Systematic / IUPAC Name: Dimethyl 3,3'-(carbonothioyldiimino)bis(2-thiophenecarboxylate)

ID: Reference6450

Other Names: 2-Thiophenecarboxylic acid, 3,3'-(carbonothioyldiimino)bis-, dimethyl ester

Formula: C13H12N2O4S3

Spectral Data

Methyl 3-[({[2-(methoxycarbonyl)-3-thienyl]amino}carbothioyl)amino]thiophene-2-carboxylate 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 Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/9/2017 9:48:27 AM
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Identificators

InChI InChI=1S/C13H12N2O4S3/c1-18-11(16)9-7(3-5-21-9)14-13(20)15-8-4-6-22-10(8)12(17)19-2/h3-6H,1-2H3,(H2,14,15,20)
InChI Key OSLDZBWQLGCYAH-UHFFFAOYSA-N
Canonical SMILES COC(=O)C1=C(C=CS1)NC(=S)NC2=C(SC=C2)C(=O)OC
CAS
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Other Names 2-Thiophenecarboxylic acid, 3,3'-(carbonothioyldiimino)bis-, dimethyl ester

In Other Databases

PubChem 2808533
ChemSpider 2086966