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1-(4-Amino-3-([2-(1-pyrrolidinyl)ethyl]sulfanyl)thieno[3,2-d]isothiazol-5-yl)ethanone
SpectraBase Compound ID CcZ854RCB6T
InChI InChI=1S/C13H17N3OS3/c1-8(17)11-10(14)9-12(15-20-13(9)19-11)18-7-6-16-4-2-3-5-16/h2-7,14H2,1H3
InChIKey ABCARJNADXRMTQ-UHFFFAOYSA-N
Mol Weight 327.48 g/mol
Molecular Formula C13H17N3OS3
Exact Mass 327.053376 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HLhzhVl5DMX
Name 1-(4-Amino-3-([2-(1-pyrrolidinyl)ethyl]sulfanyl)thieno[3,2-d]isothiazol-5-yl)ethanone
CAS Registry Number 92090-77-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17N3OS3
InChI InChI=1S/C13H17N3OS3/c1-8(17)11-10(14)9-12(15-20-13(9)19-11)18-7-6-16-4-2-3-5-16/h2-7,14H2,1H3
InChIKey ABCARJNADXRMTQ-UHFFFAOYSA-N
Molecular Weight 327.479 g/mol
SMILES Nc1c2c(nsc2sc1C(C)=O)SCCN1CCCC1
SPLASH splash10-001j-9000000000-d81a8c3b0427f6e83c85
Source of Spectrum W5-1989-37559-27977
Synonyms 1-[4-amino-3-(2-pyrrolidin-1-ylethylsulfanyl)thieno[3,2-d]isothiazol-5-yl]ethanone 1-[4-amino-3-(2-pyrrolidin-1-ylethylsulfanyl)thieno[3,2-d][1,2]thiazol-5-yl]ethanone 1-[4-amino-3-(2-pyrrolidinoethylthio)thien[3,2-d]isothiazol-5-yl]ethanone 1-[4-amino-3-[2-(1-pyrrolidinyl)ethylthio]-5-thieno[3,2-d]isothiazolyl]ethanone 1-[4-azanyl-3-(2-pyrrolidin-1-ylethylsulfanyl)thieno[3,2-d][1,2]thiazol-5-yl]ethanone 5-Acetyl-4-amino-3-(2-N-pyrrolidinylethylthio)thieno[3,2-d]isothiazole
Wiley ID 1325359