CHEBI:105057 - [4-(2-methoxyphenyl)-1-piperazinyl]-[4-[(phenylthio)methyl]phenyl]methanone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name [4-(2-methoxyphenyl)-1-piperazinyl]-[4-[(phenylthio)methyl]phenyl]methanone
ChEBI ID CHEBI:105057
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C25H26N2O2S
Net Charge 0
Average Mass 418.553
Monoisotopic Mass 418.17150
InChI InChI=1S/C25H26N2O2S/c1-29-24-10-6-5-9-23(24)26-15-17-27(18-16-26)25(28)21-13-11-20(12-14-21)19-30-22-7-3-2-4-8-22/h2-14H,15-19H2,1H3
InChIKey VRXBYMJLBWZPCK-UHFFFAOYSA-N
SMILES COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC=C(C=C3)CSC4=CC=CC=C4
ChEBI Ontology
Outgoing [4-(2-methoxyphenyl)-1-piperazinyl]-[4-[(phenylthio)methyl]phenyl]methanone (CHEBI:105057) is a piperazines (CHEBI:26144)
Manual Xref Database
LSM-16420 LINCS
View more database links