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5H-[1,3,4]thiadiazolo[3,2-a]pyridine, 6,7-dihydro-6,8-bis(4-bromophenyl-1-carbonyl)-
SpectraBase Compound ID E33JR4WtYDU
InChI InChI=1S/C22H18Br2N2O2S2/c1-2-29-22-25-26-12-15(19(27)13-3-7-16(23)8-4-13)11-18(21(26)30-22)20(28)14-5-9-17(24)10-6-14/h3-10,15H,2,11-12H2,1H3
InChIKey UBRSGLGYWNQPRM-UHFFFAOYSA-N
Mol Weight 566.33 g/mol
Molecular Formula C22H18Br2N2O2S2
Exact Mass 563.917646 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DGNl8al68uX
Name (4-bromophenyl)-[8-(4-bromophenyl)carbonyl-2-ethylsulfanyl-6,7-dihydro-5H-[1,3,4]thiadiazolo[3,2-a]pyridin-6-yl]methanone
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Formula C22H18Br2N2O2S2
InChI InChI=1S/C22H18Br2N2O2S2/c1-2-29-22-25-26-12-15(19(27)13-3-7-16(23)8-4-13)11-18(21(26)30-22)20(28)14-5-9-17(24)10-6-14/h3-10,15H,2,11-12H2,1H3
InChIKey UBRSGLGYWNQPRM-UHFFFAOYSA-N
Molecular Weight 566.326 g/mol
SMILES C12=C(CC(CN2N=C(S1)SCC)C(c1ccc(cc1)Br)=O)C(c1ccc(cc1)Br)=O
SPLASH splash10-001i-0109050000-2b48152c174555846172
Source of Spectrum U1-1998-1203-4
Synonyms (4-bromophenyl)-[8-[(4-bromophenyl)-oxomethyl]-2-(ethylthio)-6,7-dihydro-5H-[1,3,4]thiadiazolo[3,2-a]pyridin-6-yl]methanone [8-(4-bromobenzoyl)-2-(ethylthio)-6,7-dihydro-5H-[1,3,4]thiadiazolo[3,2-a]pyridin-6-yl]-(4-bromophenyl)methanone [8-(4-bromobenzoyl)-2-ethylsulfanyl-6,7-dihydro-5H-[1,3,4]thiadiazolo[3,2-a]pyridin-6-yl]-(4-bromophenyl)methanone
Wiley ID 751365