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CHEBI:116348 - 1-amino-3-(4-chloro-2-methoxy-5-methylphenyl)thiourea

ChEBI IDCHEBI:116348
ChEBI Name1-amino-3-(4-chloro-2-methoxy-5-methylphenyl)thiourea
Stars
DownloadsMolfile
FormulaC9H12ClN3OS
Net Charge0
Average Mass245.735
Monoisotopic Mass245.03896
SMILESCOc1cc(Cl)c(C)cc1NC(=S)NN
InChIInChI=1S/C9H12ClN3OS/c1-5-3-7(12-9(15)13-11)8(14-2)4-6(5)10/h3-4H,11H2,1-2H3,(H2,12,13,15)
InChIKeyYVCJRAQYWBIIEG-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-amino-3-(4-chloro-2-methoxy-5-methylphenyl)thiourea (CHEBI:116348) is a methoxybenzenes (CHEBI:51683)
1-amino-3-(4-chloro-2-methoxy-5-methylphenyl)thiourea (CHEBI:116348) is a substituted aniline (CHEBI:48975)
Manual XrefsDatabases
LSM-27802LINCS