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4-(1-piperidinyl)-6-[[(4-prop-2-enyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]methyl]-1,3,5-triazin-2-amine
SpectraBase Compound ID J9AHh0oDkar
InChI InChI=1S/C18H22N8S2/c1-2-8-26-15(13-7-6-11-27-13)23-24-18(26)28-12-14-20-16(19)22-17(21-14)25-9-4-3-5-10-25/h2,6-7,11H,1,3-5,8-10,12H2,(H2,19,20,21,22)
InChIKey BCQAMSBVDJEYDZ-UHFFFAOYSA-N
Mol Weight 414.55 g/mol
Molecular Formula C18H22N8S2
Exact Mass 414.140885 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FlBJIfKtvNF
Name 4-(1-piperidinyl)-6-[[(4-prop-2-enyl-5-thiophen-2-yl-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 C18H22N8S2
InChI InChI=1S/C18H22N8S2/c1-2-8-26-15(13-7-6-11-27-13)23-24-18(26)28-12-14-20-16(19)22-17(21-14)25-9-4-3-5-10-25/h2,6-7,11H,1,3-5,8-10,12H2,(H2,19,20,21,22)
InChIKey BCQAMSBVDJEYDZ-UHFFFAOYSA-N
Molecular Weight 414.550 g/mol
SMILES Nc1nc(nc(n1)CSc1[n](c(nn1)-c1sccc1)CC=C)N1CCCCC1
SPLASH splash10-0006-5910000000-c15e477fc59393579355
Synonyms 4-Piperidin-1-yl-6-[(4-prop-2-enyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,5-triazin-2-amine 4-[[4-allyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-6-(1-piperidyl)-1,3,5-triazin-2-amine [4-[[[4-allyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]methyl]-6-piperidino-s-triazin-2-yl]amine
Wiley ID 1442189