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3-Benzyl-7-[5-(4-bromophenyl)-2-furyl]-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
SpectraBase Compound ID BuWiFXm2rCY
InChI InChI=1S/C21H13BrN4O2S/c22-15-8-6-14(7-9-15)17-10-11-18(28-17)19-25-26-20(27)16(23-24-21(26)29-19)12-13-4-2-1-3-5-13/h1-11H,12H2
InChIKey ADRDQCSRAMKRMN-UHFFFAOYSA-N
Mol Weight 465.33 g/mol
Molecular Formula C21H13BrN4O2S
Exact Mass 463.99426 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D5WNOOLEuj6
Name 3-Benzyl-7-[5-(4-bromophenyl)-2-furyl]-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H13BrN4O2S
InChI InChI=1S/C21H13BrN4O2S/c22-15-8-6-14(7-9-15)17-10-11-18(28-17)19-25-26-20(27)16(23-24-21(26)29-19)12-13-4-2-1-3-5-13/h1-11H,12H2
InChIKey ADRDQCSRAMKRMN-UHFFFAOYSA-N
Molecular Weight 465.325 g/mol
SMILES C12=NN=C(C(N2N=C(S1)c1oc(cc1)-c1ccc(cc1)Br)=O)Cc1ccccc1
SPLASH splash10-02t9-0000900000-4742a74168b1dc7d5311
Source of Spectrum Y1-41-2691-3
Synonyms 3-Benzyl-7-[5-(4-bromophenyl)furan-2-yl]-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one 7-[5-(4-bromophenyl)-2-furanyl]-3-(phenylmethyl)-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one 7-[5-(4-bromophenyl)furan-2-yl]-3-(phenylmethyl)-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
Wiley ID 1565123