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CHEBI:124646 - 4-chloro-N-(3,4,5-trimethoxyphenyl)-5-dithiazolimine

ChEBI IDCHEBI:124646
ChEBI Name4-chloro-N-(3,4,5-trimethoxyphenyl)-5-dithiazolimine
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FormulaC11H11ClN2O3S2
Net Charge0
Average Mass318.807
Monoisotopic Mass317.98996
SMILESCOc1cc(N=c2ssnc2Cl)cc(OC)c1OC
InChIInChI=1S/C11H11ClN2O3S2/c1-15-7-4-6(5-8(16-2)9(7)17-3)13-11-10(12)14-19-18-11/h4-5H,1-3H3
InChIKeyRFUGMMCRDMJZMS-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)
4-chloro-N-(3,4,5-trimethoxyphenyl)-5-dithiazolimine (CHEBI:124646) is a methoxybenzenes (CHEBI:51683)
4-chloro-N-(3,4,5-trimethoxyphenyl)-5-dithiazolimine (CHEBI:124646) is a substituted aniline (CHEBI:48975)
Manual XrefsDatabases
LSM-36088LINCS