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CHEBI:115638 - 1-[[(4-bromo-2-methyl-3-pyrazolyl)-oxomethyl]amino]-3-(2-methoxy-5-methylphenyl)thiourea

ChEBI IDCHEBI:115638
ChEBI Name1-[[(4-bromo-2-methyl-3-pyrazolyl)-oxomethyl]amino]-3-(2-methoxy-5-methylphenyl)thiourea
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DownloadsMolfile
FormulaC14H16BrN5O2S
Net Charge0
Average Mass398.286
Monoisotopic Mass397.02081
SMILESCOc1ccc(C)cc1NC(=S)NNC(=O)c1c(Br)cnn1C
InChIInChI=1S/C14H16BrN5O2S/c1-8-4-5-11(22-3)10(6-8)17-14(23)19-18-13(21)12-9(15)7-16-20(12)2/h4-7H,1-3H3,(H,18,21)(H2,17,19,23)
InChIKeySNWMANMTUVGILJ-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
1-[[(4-bromo-2-methyl-3-pyrazolyl)-oxomethyl]amino]-3-(2-methoxy-5-methylphenyl)thiourea (CHEBI:115638) is a methoxybenzenes (CHEBI:51683)
1-[[(4-bromo-2-methyl-3-pyrazolyl)-oxomethyl]amino]-3-(2-methoxy-5-methylphenyl)thiourea (CHEBI:115638) is a substituted aniline (CHEBI:48975)
Manual XrefsDatabases
LSM-27095LINCS