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

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ChEBI Name 4-chloro-N-(3,4,5-trimethoxyphenyl)-5-dithiazolimine
ChEBI ID CHEBI:124646
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C11H11ClN2O3S2
Net Charge 0
Average Mass 318.802
Monoisotopic Mass 317.98996
InChI InChI=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
InChIKey RFUGMMCRDMJZMS-UHFFFAOYSA-N
SMILES COC1=CC(=CC(=C1OC)OC)N=C2C(=NSS2)Cl
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing 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 Xref Database
LSM-36088 LINCS
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