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CHEBI:140906 - 1-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-N-methyl-3,4-dihydro-1H-isochromene-6-carboxamide

ChEBI IDCHEBI:140906
ChEBI Name1-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-N-methyl-3,4-dihydro-1H-isochromene-6-carboxamide
Stars
SubmitterCeri
DownloadsMolfile
FormulaC24H31N3O3
Net Charge0
Average Mass409.530
Monoisotopic Mass409.23654
SMILESCNC(=O)c1ccc2c(c1)CCOC2CCN1CCN(c2ccc(OC)cc2)CC1
InChIInChI=1S/C24H31N3O3/c1-25-24(28)19-3-8-22-18(17-19)10-16-30-23(22)9-11-26-12-14-27(15-13-26)20-4-6-21(29-2)7-5-20/h3-8,17,23H,9-16H2,1-2H3,(H,25,28)
InChIKeyUDLSEQDYARNKTL-UHFFFAOYSA-N
Roles Classification
Application:
receptor modulator  A drug that acts as an antagonist, agonist, reverse agonist, or in some other fashion when interacting with cellular receptors.
ChEBI Ontology
Outgoing Relation(s)
1-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-N-methyl-3,4-dihydro-1H-isochromene-6-carboxamide (CHEBI:140906) has role receptor modulator (CHEBI:90710)
1-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-N-methyl-3,4-dihydro-1H-isochromene-6-carboxamide (CHEBI:140906) is a organic molecular entity (CHEBI:50860)
1-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-N-methyl-3,4-dihydro-1H-isochromene-6-carboxamide (CHEBI:140906) is a organonitrogen heterocyclic compound (CHEBI:38101)
Synonyms  Source
PNU 109291SUBMITTER
PNU-109291SUBMITTER
Registry NumbersSources
CAS:187665-60-7SUBMITTER