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CHEBI:92581 - 1-[3-[(5-bromo-2-pyridinyl)-(phenylmethyl)amino]propyl]-3-[3-(1H-imidazol-5-yl)propyl]thiourea

ChEBI IDCHEBI:92581
ChEBI Name1-[3-[(5-bromo-2-pyridinyl)-(phenylmethyl)amino]propyl]-3-[3-(1H-imidazol-5-yl)propyl]thiourea
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FormulaC22H27BrN6S
Net Charge0
Average Mass487.471
Monoisotopic Mass486.12013
SMILESS=C(NCCCc1cncn1)NCCCN(Cc1ccccc1)c1ccc(Br)cn1
InChIInChI=1S/C22H27BrN6S/c23-19-9-10-21(27-14-19)29(16-18-6-2-1-3-7-18)13-5-12-26-22(30)25-11-4-8-20-15-24-17-28-20/h1-3,6-7,9-10,14-15,17H,4-5,8,11-13,16H2,(H,24,28)(H2,25,26,30)
InChIKeyJSFKWPGDWYVELH-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
1-[3-[(5-bromo-2-pyridinyl)-(phenylmethyl)amino]propyl]-3-[3-(1H-imidazol-5-yl)propyl]thiourea (CHEBI:92581) is a aminopyridine (CHEBI:38207)
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