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2-Pyrrol5-[(2,6-dimethylphenylamino)-methyl]-4-methyl-4H-[1,2,4]triazol-3-ylsulfanylmorpho-1-morpholin-4-yl-ethanone
SpectraBase Compound ID EH6ibtPTqWg
InChI InChI=1S/C18H25N5O2S/c1-13-5-4-6-14(2)17(13)19-11-15-20-21-18(22(15)3)26-12-16(24)23-7-9-25-10-8-23/h4-6,19H,7-12H2,1-3H3
InChIKey LHRZMGNYWBWENX-UHFFFAOYSA-N
Mol Weight 375.49 g/mol
Molecular Formula C18H25N5O2S
Exact Mass 375.172896 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jd692Au9aBP
Name 2-Pyrrol5-[(2,6-dimethylphenylamino)-methyl]-4-methyl-4H-[1,2,4]triazol-3-ylsulfanylmorpho-1-morpholin-4-yl-ethanone
Alternate Name(s) 2-[[5-[(2,6-dimethylanilino)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-morpholin-4-ylethanone 2-[[5-[(2,6-dimethylanilino)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-morpholino-ethanone 2-[[5-[(2,6-dimethylanilino)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]-1-(4-morpholinyl)ethanone 2-[[5-[(2,6-dimethylanilino)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]-1-morpholino-ethanone 2-[[5-[[(2,6-dimethylphenyl)amino]methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-morpholin-4-yl-ethanone
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Formula C18H25N5O2S
InChI InChI=1S/C18H25N5O2S/c1-13-5-4-6-14(2)17(13)19-11-15-20-21-18(22(15)3)26-12-16(24)23-7-9-25-10-8-23/h4-6,19H,7-12H2,1-3H3
InChIKey LHRZMGNYWBWENX-UHFFFAOYSA-N
Molecular Weight 375.491 g/mol
SMILES N(c1c(cccc1C)C)Cc1[n](c(nn1)SCC(=O)N1CCOCC1)C
SPLASH splash10-05ea-5933000000-98ebca25e2238d37d78d
Wiley ID 1440874