CHEBI:123339 - N-(4-bromophenyl)-2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]benzamide

ChEBI IDCHEBI:123339
ChEBI NameN-(4-bromophenyl)-2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]benzamide
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Last Modified6 March 2019
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FormulaC21H16BrN3OS2
Net Charge0
Average Mass470.417
Monoisotopic Mass468.99182
SMILESCc1sc2ncnc(Sc3ccccc3C(=O)Nc3ccc(Br)cc3)c2c1C
InChIInChI=1S/C21H16BrN3OS2/c1-12-13(2)27-20-18(12)21(24-11-23-20)28-17-6-4-3-5-16(17)19(26)25-15-9-7-14(22)8-10-15/h3-11H,1-2H3,(H,25,26)
InChIKeyXVONCLBBPYXJHJ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-(4-bromophenyl)-2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]benzamide (CHEBI:123339) is a benzamides (CHEBI:22702)
N-(4-bromophenyl)-2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]benzamide (CHEBI:123339) is a thienopyrimidine (CHEBI:143212)
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