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CHEBI:121839 - 4-[[4-(1,3-benzothiazol-2-yl)-1-piperazinyl]-[1-(2-phenylethyl)-5-tetrazolyl]methyl]phenol

ChEBI IDCHEBI:121839
ChEBI Name4-[[4-(1,3-benzothiazol-2-yl)-1-piperazinyl]-[1-(2-phenylethyl)-5-tetrazolyl]methyl]phenol
Stars
DownloadsMolfile
FormulaC27H27N7OS
Net Charge0
Average Mass497.628
Monoisotopic Mass497.19978
SMILESOc1ccc(C(c2nnnn2CCc2ccccc2)N2CCN(c3nc4ccccc4s3)CC2)cc1
InChIInChI=1S/C27H27N7OS/c35-22-12-10-21(11-13-22)25(26-29-30-31-34(26)15-14-20-6-2-1-3-7-20)32-16-18-33(19-17-32)27-28-23-8-4-5-9-24(23)36-27/h1-13,25,35H,14-19H2
InChIKeyVYVKXMZQZSGWEY-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)
4-[[4-(1,3-benzothiazol-2-yl)-1-piperazinyl]-[1-(2-phenylethyl)-5-tetrazolyl]methyl]phenol (CHEBI:121839) is a N-arylpiperazine (CHEBI:46848)
Manual XrefsDatabases
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