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CHEBI:120633 - 5-(4-bromophenyl)-N-[[(2-propyl-5-tetrazolyl)amino]-sulfanylidenemethyl]-2-furancarboxamide

ChEBI IDCHEBI:120633
ChEBI Name5-(4-bromophenyl)-N-[[(2-propyl-5-tetrazolyl)amino]-sulfanylidenemethyl]-2-furancarboxamide
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FormulaC16H15BrN6O2S
Net Charge0
Average Mass435.307
Monoisotopic Mass434.01606
SMILESCCCn1nnc(NC(=S)NC(=O)c2ccc(-c3ccc(Br)cc3)o2)n1
InChIInChI=1S/C16H15BrN6O2S/c1-2-9-23-21-15(20-22-23)19-16(26)18-14(24)13-8-7-12(25-13)10-3-5-11(17)6-4-10/h3-8H,2,9H2,1H3,(H2,18,19,21,24,26)
InChIKeyMPPNRIHCUHCBFR-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
5-(4-bromophenyl)-N-[[(2-propyl-5-tetrazolyl)amino]-sulfanylidenemethyl]-2-furancarboxamide (CHEBI:120633) is a furoic acid (CHEBI:36055)
Manual XrefsDatabases
LSM-32075LINCS