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

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ChEBI Name N-(4-bromophenyl)-2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]benzamide
ChEBI ID CHEBI:123339
Stars This entity has been manually annotated by a third party.
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Formula C21H16BrN3OS2
Net Charge 0
Average Mass 470.408
Monoisotopic Mass 468.99182
InChI InChI=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)
InChIKey XVONCLBBPYXJHJ-UHFFFAOYSA-N
SMILES CC1=C(SC2=C1C(=NC=N2)SC3=CC=CC=C3C(=O)NC4=CC=C(C=C4)Br)C
ChEBI Ontology
Outgoing 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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Last Modified
06 March 2019