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2-(3,5-Dimethylpiperazin-1-yl)-5-(1-methyl-5-nitro-1H-imidazol-2-yl)-1,3,4-thiadiazole
SpectraBase Compound ID JLjXFRlsImG
InChI InChI=1S/C12H17N7O2S/c1-7-5-18(6-8(2)14-7)12-16-15-11(22-12)10-13-4-9(17(10)3)19(20)21/h4,7-8,14H,5-6H2,1-3H3
InChIKey IANDGHDIENPYAD-UHFFFAOYSA-N
Mol Weight 323.38 g/mol
Molecular Formula C12H17N7O2S
Exact Mass 323.116444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HiAkTiJN2EF
Name 2-(3,5-Dimethylpiperazin-1-yl)-5-(1-methyl-5-nitro-1H-imidazol-2-yl)-1,3,4-thiadiazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17N7O2S
InChI InChI=1S/C12H17N7O2S/c1-7-5-18(6-8(2)14-7)12-16-15-11(22-12)10-13-4-9(17(10)3)19(20)21/h4,7-8,14H,5-6H2,1-3H3
InChIKey IANDGHDIENPYAD-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.201000013
Molecular Weight 323.375 g/mol
SMILES N1C(CN(CC1C)c1sc(-c2[n](c(cn2)[N+](=O)[O-])C)nn1)C
SPLASH splash10-00e9-9010000000-f2ab157fd7c7bb28ff05
Source of Spectrum APC-344-182-6f
Synonyms 2-(3,5-dimethyl-1-piperazinyl)-5-(1-methyl-5-nitro-2-imidazolyl)-1,3,4-thiadiazole 2-(3,5-dimethylpiperazin-1-yl)-5-(1-methyl-5-nitroimidazol-2-yl)-1,3,4-thiadiazole 2-(3,5-dimethylpiperazin-1-yl)-5-(1-methyl-5-nitro-imidazol-2-yl)-1,3,4-thiadiazole
Wiley ID 1769205