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N-[(1-methyl-5-nitro-imidazol-2-yl)carbothioylamino]methanethioamide
SpectraBase Compound ID JpDLrzzbNIl
InChI InChI=1S/C6H7N5O2S2/c1-10-4(11(12)13)2-7-5(10)6(15)9-8-3-14/h2-3H,1H3,(H,8,14)(H,9,15)
InChIKey CQQFJMRQRVXOKM-UHFFFAOYSA-N
Mol Weight 245.28 g/mol
Molecular Formula C6H7N5O2S2
Exact Mass 245.004117 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AkX5qSeHTW2
Name N-[(1-methyl-5-nitro-imidazol-2-yl)carbothioylamino]methanethioamide
CAS Registry Number 126865-24-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H7N5O2S2
InChI InChI=1S/C6H7N5O2S2/c1-10-4(11(12)13)2-7-5(10)6(15)9-8-3-14/h2-3H,1H3,(H,8,14)(H,9,15)
InChIKey CQQFJMRQRVXOKM-UHFFFAOYSA-N
Molecular Weight 245.275 g/mol
SMILES N(C(c1[n](c(N(=O)=O)cn1)C)=S)NC=S
SPLASH splash10-0006-9580000000-9f5b0386a23f7311eda8
Source of Spectrum Y-26-1343-9
Synonyms N-[(1-methyl-5-nitro-imidazole-2-carbothioyl)amino]thioformamide N-[(1-methyl-5-nitroimidazole-2-carbothioyl)amino]methanethioamide N-[[(1-methyl-5-nitro-2-imidazolyl)-sulfanylidenemethyl]amino]methanethioamide
Wiley ID 1247709