CHEBI:114661 - 4-(2,5-dimethoxyphenyl)-3-(3-phenyl-1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione

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ChEBI Name 4-(2,5-dimethoxyphenyl)-3-(3-phenyl-1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione
ChEBI ID CHEBI:114661
Stars This entity has been manually annotated by a third party.
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Formula C19H17N5O2S
Net Charge 0
Average Mass 379.437
Monoisotopic Mass 379.11030
InChI InChI=1S/C19H17N5O2S/c1-25-13-8-9-17(26-2)16(10-13)24-18(22-23-19(24)27)15-11-14(20-21-15)12-6-4-3-5-7-12/h3-11H,1-2H3,(H,20,21)(H,23,27)
InChIKey RWFZAKSDPNBBPR-UHFFFAOYSA-N
SMILES COC1=CC(=C(C=C1)OC)N2C(=NNC2=S)C3=CC(=NN3)C4=CC=CC=C4
ChEBI Ontology
Outgoing 4-(2,5-dimethoxyphenyl)-3-(3-phenyl-1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione (CHEBI:114661) is a pyrazoles (CHEBI:26410)
4-(2,5-dimethoxyphenyl)-3-(3-phenyl-1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione (CHEBI:114661) is a ring assembly (CHEBI:36820)
Manual Xref Database
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