CHEBI:107740 - 1-(4-hydroxyphenyl)-3-[4-[(4-methyl-1,2,4-triazol-3-yl)thio]-3-nitrophenyl]-2-propen-1-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1-(4-hydroxyphenyl)-3-[4-[(4-methyl-1,2,4-triazol-3-yl)thio]-3-nitrophenyl]-2-propen-1-one
ChEBI ID CHEBI:107740
Stars This entity has been manually annotated by a third party.
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Formula C18H14N4O4S
Net Charge 0
Average Mass 382.395
Monoisotopic Mass 382.07358
InChI InChI=1S/C18H14N4O4S/c1-21-11-19-20-18(21)27-17-9-3-12(10-15(17)22(25)26)2-8-16(24)13-4-6-14(23)7-5-13/h2-11,23H,1H3
InChIKey PVHHKNYFQPGGSN-UHFFFAOYSA-N
SMILES CN1C=NN=C1SC2=C(C=C(C=C2)C=CC(=O)C3=CC=C(C=C3)O)[N+](=O)[O-]
ChEBI Ontology
Outgoing 1-(4-hydroxyphenyl)-3-[4-[(4-methyl-1,2,4-triazol-3-yl)thio]-3-nitrophenyl]-2-propen-1-one (CHEBI:107740) is a chalcones (CHEBI:23086)
Manual Xref Database
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