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4-(1-piperidinyl)-6-[[[4-prop-2-enyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]methyl]-1,3,5-triazin-2-amine
SpectraBase Compound ID BDC9va4psMJ
InChI InChI=1S/C19H23N9S/c1-2-9-28-16(14-7-6-8-21-12-14)25-26-19(28)29-13-15-22-17(20)24-18(23-15)27-10-4-3-5-11-27/h2,6-8,12H,1,3-5,9-11,13H2,(H2,20,22,23,24)
InChIKey GCWAKBUSJTYDMI-UHFFFAOYSA-N
Mol Weight 409.52 g/mol
Molecular Formula C19H23N9S
Exact Mass 409.179713 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gsbo8nUROma
Name 4-(1-piperidinyl)-6-[[[4-prop-2-enyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]methyl]-1,3,5-triazin-2-amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H23N9S
InChI InChI=1S/C19H23N9S/c1-2-9-28-16(14-7-6-8-21-12-14)25-26-19(28)29-13-15-22-17(20)24-18(23-15)27-10-4-3-5-11-27/h2,6-8,12H,1,3-5,9-11,13H2,(H2,20,22,23,24)
InChIKey GCWAKBUSJTYDMI-UHFFFAOYSA-N
Molecular Weight 409.516 g/mol
SMILES Nc1nc(nc(n1)CSc1[n](c(nn1)-c1cnccc1)CC=C)N1CCCCC1
SPLASH splash10-0006-4900000000-bf5eb6bb69d2b73b028f
Synonyms 4-Piperidin-1-yl-6-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,5-triazin-2-amine 4-[[4-allyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-6-(1-piperidyl)-1,3,5-triazin-2-amine [4-[[[4-allyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]-6-piperidino-s-triazin-2-yl]amine
Wiley ID 1442190