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CHEBI:112444 - 1-[[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]methylideneamino]-3-propan-2-ylthiourea

ChEBI IDCHEBI:112444
ChEBI Name1-[[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]methylideneamino]-3-propan-2-ylthiourea
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DownloadsMolfile
FormulaC22H25N5O2S
Net Charge0
Average Mass423.542
Monoisotopic Mass423.17290
SMILESCOc1ccc(-c2nn(-c3ccccc3)cc2C=NNC(=S)NC(C)C)cc1OC
InChIInChI=1S/C22H25N5O2S/c1-15(2)24-22(30)25-23-13-17-14-27(18-8-6-5-7-9-18)26-21(17)16-10-11-19(28-3)20(12-16)29-4/h5-15H,1-4H3,(H2,24,25,30)
InChIKeyZVFFIDHMEKYLRE-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]methylideneamino]-3-propan-2-ylthiourea (CHEBI:112444) is a pyrazoles (CHEBI:26410)
1-[[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]methylideneamino]-3-propan-2-ylthiourea (CHEBI:112444) is a ring assembly (CHEBI:36820)
Manual XrefsDatabases
LSM-23856LINCS