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CHEBI:104231 - 1-[2-[(4-methylphenyl)thio]ethyl]-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine

ChEBI IDCHEBI:104231
ChEBI Name1-[2-[(4-methylphenyl)thio]ethyl]-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine
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DownloadsMolfile
FormulaC23H32N2O3S
Net Charge0
Average Mass416.587
Monoisotopic Mass416.21336
SMILESCOc1ccc(CN2CCN(CCSc3ccc(C)cc3)CC2)c(OC)c1OC
InChIInChI=1S/C23H32N2O3S/c1-18-5-8-20(9-6-18)29-16-15-24-11-13-25(14-12-24)17-19-7-10-21(26-2)23(28-4)22(19)27-3/h5-10H,11-17H2,1-4H3
InChIKeyMAXODDXKVCZCAU-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-[2-[(4-methylphenyl)thio]ethyl]-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine (CHEBI:104231) is a aromatic amine (CHEBI:33860)
Manual XrefsDatabases
LSM-15595LINCS