CHEBI:104166 - [4-[[4-(methylthio)phenyl]methyl]-1-piperazinyl]-(4-nitrophenyl)methanone

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ChEBI Name [4-[[4-(methylthio)phenyl]methyl]-1-piperazinyl]-(4-nitrophenyl)methanone
ChEBI ID CHEBI:104166
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C19H21N3O3S
Net Charge 0
Average Mass 371.455
Monoisotopic Mass 371.13036
InChI InChI=1S/C19H21N3O3S/c1-26-18-8-2-15(3-9-18)14-20-10-12-21(13-11-20)19(23)16-4-6-17(7-5-16)22(24)25/h2-9H,10-14H2,1H3
InChIKey RBIMEIXDDYSEGP-UHFFFAOYSA-N
SMILES CSC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]
ChEBI Ontology
Outgoing [4-[[4-(methylthio)phenyl]methyl]-1-piperazinyl]-(4-nitrophenyl)methanone (CHEBI:104166) is a C-nitro compound (CHEBI:35716)
Manual Xref Database
LSM-15530 LINCS
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