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4-Ethyl-5-(2-thienyl)-2-(9H-xanthen-9-yl)-1,2,4-triazole-3-thione
SpectraBase Compound ID DZs4HeZp3ZU
InChI InChI=1S/C21H17N3OS2/c1-2-23-20(18-12-7-13-27-18)22-24(21(23)26)19-14-8-3-5-10-16(14)25-17-11-6-4-9-15(17)19/h3-13,19H,2H2,1H3
InChIKey SZMYJMZODWVYDN-UHFFFAOYSA-N
Mol Weight 391.51 g/mol
Molecular Formula C21H17N3OS2
Exact Mass 391.081305 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9NBFFDeAOss
Name 4-Ethyl-5-(2-thienyl)-2-(9H-xanthen-9-yl)-1,2,4-triazole-3-thione
Alternate Name(s) 4-Ethyl-5-thiophen-2-yl-2-(9H-xanthen-9-yl)-1,2,4-triazole-3-thione [1,2,4]Triazole-3-thione, 4-ethyl-5-(thiophen-2-yl)-2-(9H-xanthen-9-yl)-2,4-dihydro-
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Formula C21H17N3OS2
InChI InChI=1S/C21H17N3OS2/c1-2-23-20(18-12-7-13-27-18)22-24(21(23)26)19-14-8-3-5-10-16(14)25-17-11-6-4-9-15(17)19/h3-13,19H,2H2,1H3
InChIKey SZMYJMZODWVYDN-UHFFFAOYSA-N
Molecular Weight 391.507 g/mol
SMILES c1ccsc1C1=NN(C2c3c(Oc4ccccc24)cccc3)C(N1CC)=S
SPLASH splash10-001i-1900000000-618f621bf8ffdb3c8e0b
Wiley ID 1445991