CHEBI:109563 - 1-(4-methoxyphenyl)-4-[(4-methylphenyl)thio]-6-oxo-3-pyridazinecarboxylic acid methyl ester

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ChEBI Name 1-(4-methoxyphenyl)-4-[(4-methylphenyl)thio]-6-oxo-3-pyridazinecarboxylic acid methyl ester
ChEBI ID CHEBI:109563
Stars This entity has been manually annotated by a third party.
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Formula C20H18N2O4S
Net Charge 0
Average Mass 382.435
Monoisotopic Mass 382.09873
InChI InChI=1S/C20H18N2O4S/c1-13-4-10-16(11-5-13)27-17-12-18(23)22(21-19(17)20(24)26-3)14-6-8-15(25-2)9-7-14/h4-12H,1-3H3
InChIKey DGMPKQJUJSNOBV-UHFFFAOYSA-N
SMILES CC1=CC=C(C=C1)SC2=CC(=O)N(N=C2C(=O)OC)C3=CC=C(C=C3)OC
ChEBI Ontology
Outgoing 1-(4-methoxyphenyl)-4-[(4-methylphenyl)thio]-6-oxo-3-pyridazinecarboxylic acid methyl ester (CHEBI:109563) is a aryl sulfide (CHEBI:35683)
Manual Xref Database
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