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2-[[4-allyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
SpectraBase Compound ID CxBbxys05Mm
InChI InChI=1S/C19H18N4O3S2/c1-2-7-23-18(16-4-3-10-27-16)21-22-19(23)28-12-17(24)20-13-5-6-14-15(11-13)26-9-8-25-14/h2-6,10-11H,1,7-9,12H2,(H,20,24)
InChIKey SNHVQGYGBHBRMC-UHFFFAOYSA-N
Mol Weight 414.5 g/mol
Molecular Formula C19H18N4O3S2
Exact Mass 414.082033 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3JQp5jhp8r3
Name 2-[[4-allyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
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Formula C19H18N4O3S2
InChI InChI=1S/C19H18N4O3S2/c1-2-7-23-18(16-4-3-10-27-16)21-22-19(23)28-12-17(24)20-13-5-6-14-15(11-13)26-9-8-25-14/h2-6,10-11H,1,7-9,12H2,(H,20,24)
InChIKey SNHVQGYGBHBRMC-UHFFFAOYSA-N
Molecular Weight 414.498 g/mol
SMILES N(C(CSc1[n](c(nn1)-c1sccc1)CC=C)=O)c1cc2OCCOc2cc1
SPLASH splash10-0gvx-9840000000-976830a2c6b4e2e9abcc
Synonyms 2-[[4-allyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4-prop-2-enyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4-prop-2-enyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4-prop-2-enyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]acetamide
Wiley ID 1442588