CHEBI:121390 - 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[5-methyl-2-(4-methylphenyl)-4-oxazolyl]methylsulfonyl]ethanone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[5-methyl-2-(4-methylphenyl)-4-oxazolyl]methylsulfonyl]ethanone
ChEBI ID CHEBI:121390
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C23H24N2O4S
Net Charge 0
Average Mass 424.515
Monoisotopic Mass 424.14568
InChI InChI=1S/C23H24N2O4S/c1-16-7-9-19(10-8-16)23-24-21(17(2)29-23)14-30(27,28)15-22(26)25-12-11-18-5-3-4-6-20(18)13-25/h3-10H,11-15H2,1-2H3
InChIKey GCVQIGHVKKCWJF-UHFFFAOYSA-N
SMILES CC1=CC=C(C=C1)C2=NC(=C(O2)C)CS(=O)(=O)CC(=O)N3CCC4=CC=CC=C4C3
ChEBI Ontology
Outgoing 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[5-methyl-2-(4-methylphenyl)-4-oxazolyl]methylsulfonyl]ethanone (CHEBI:121390) is a 1,3-oxazoles (CHEBI:46812)
Manual Xref Database
LSM-32833 LINCS
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