CHEBI:119901 - N-[5-ethyl-3-[(4-methoxyphenyl)-oxomethyl]-2-thiophenyl]-2-(4-methyl-1-piperazinyl)acetamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-[5-ethyl-3-[(4-methoxyphenyl)-oxomethyl]-2-thiophenyl]-2-(4-methyl-1-piperazinyl)acetamide
ChEBI ID CHEBI:119901
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C21H27N3O3S
Net Charge 0
Average Mass 401.524
Monoisotopic Mass 401.17731
InChI InChI=1S/C21H27N3O3S/c1-4-17-13-18(20(26)15-5-7-16(27-3)8-6-15)21(28-17)22-19(25)14-24-11-9-23(2)10-12-24/h5-8,13H,4,9-12,14H2,1-3H3,(H,22,25)
InChIKey PGLUPFDXMXYLKD-UHFFFAOYSA-N
SMILES CCC1=CC(=C(S1)NC(=O)CN2CCN(CC2)C)C(=O)C3=CC=C(C=C3)OC
ChEBI Ontology
Outgoing N-[5-ethyl-3-[(4-methoxyphenyl)-oxomethyl]-2-thiophenyl]-2-(4-methyl-1-piperazinyl)acetamide (CHEBI:119901) is a aromatic ketone (CHEBI:76224)
Manual Xref Database
LSM-31345 LINCS
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