1-(1,3-BENZODIOXOL-5-YL)-2-[[4-(4-BROMOPHENYL)-5-(4-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]ETHANONE

pro_cas
618432-36-3
pro_cdbregno
CCD00366757
pro_formula
C22 H15 Br N4 O3 S
pro_molWeight
495.355

basic_info

Product_Name: 1-(1,3-BENZODIOXOL-5-YL)-2-[[4-(4-BROMOPHENYL)-5-(4-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]ETHANONE
CAS: 618432-36-3
EnglishSynonyms: 1-(1,3-BENZODIOXOL-5-YL)-2-[[4-(4-BROMOPHENYL)-5-(4-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]ETHANONE
pro_mdlNumber: MFCD03224604
pro_acceptors: 7
pro_donors: 0
pro_smile: c1cc(ccc1n2c(nnc2SCC(=O)c3ccc4c(c3)OCO4)c5ccncc5)Br
InChi: InChI=1S/C22H15BrN4O3S/c23-16-2-4-17(5-3-16)27-21(14-7-9-24-10-8-14)25-26-22(27)31-12-18(28)15-1-6-19-20(11-15)30-13-29-19/h1-11H,12-13H2
InChiKey: InChIKey=DKRNYCIXQMKGBE-UHFFFAOYSA-N

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