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Ethyl 2-([(methylsulfanyl)carbothioyl]amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID AqSBZS6MvEC
InChI InChI=1S/C13H17NO2S3/c1-3-16-12(15)10-8-6-4-5-7-9(8)19-11(10)14-13(17)18-2/h3-7H2,1-2H3,(H,14,17)
InChIKey RMNFVEIFRCKOBS-UHFFFAOYSA-N
Mol Weight 315.46 g/mol
Molecular Formula C13H17NO2S3
Exact Mass 315.042142 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ELIhGLsY3nn
Name Ethyl 2-([(methylsulfanyl)carbothioyl]amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Alternate Name(s) 2-Methylsulfanylthiocarbonylamino-4,5,6,7-tetrahydro-benzo[b]thiophene-3-carboxylic acid ethyl ester 2-[(methylthio)carbothioylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester 2-[[(methylthio)-sulfanylidenemethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester Benzothiophene-3-carboxylic acid, 4,5,6,7-terahydro-2-methylthio(thiocarbonyl)amino-, ethyl ester Ethyl 2-(methylsulfanylcarbothioylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate
CAS Registry Number 155686-60-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO2S3
InChI InChI=1S/C13H17NO2S3/c1-3-16-12(15)10-8-6-4-5-7-9(8)19-11(10)14-13(17)18-2/h3-7H2,1-2H3,(H,14,17)
InChIKey RMNFVEIFRCKOBS-UHFFFAOYSA-N
Molecular Weight 315.464 g/mol
SMILES N(c1c(c2CCCCc2s1)C(=O)OCC)C(=S)SC
SPLASH splash10-00di-7981000000-80ceecff65013bdbf0e2
Wiley ID 1456017