CHEBI:92134 - N-(5-chloro-2-methoxyphenyl)-5-pyridin-4-yl-1,3,4-thiadiazol-2-amine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-(5-chloro-2-methoxyphenyl)-5-pyridin-4-yl-1,3,4-thiadiazol-2-amine
ChEBI ID CHEBI:92134
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C14H11ClN4OS
Net Charge 0
Average Mass 318.783
Monoisotopic Mass 318.03421
InChI InChI=1S/C14H11ClN4OS/c1-20-12-3-2-10(15)8-11(12)17-14-19-18-13(21-14)9-4-6-16-7-5-9/h2-8H,1H3,(H,17,19)
InChIKey XKVVTHNIBOARFW-UHFFFAOYSA-N
SMILES COC1=C(C=C(C=C1)Cl)NC2=NN=C(S2)C3=CC=NC=C3
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing N-(5-chloro-2-methoxyphenyl)-5-pyridin-4-yl-1,3,4-thiadiazol-2-amine (CHEBI:92134) is a methoxybenzenes (CHEBI:51683)
N-(5-chloro-2-methoxyphenyl)-5-pyridin-4-yl-1,3,4-thiadiazol-2-amine (CHEBI:92134) is a substituted aniline (CHEBI:48975)
Manual Xref Database
LSM-2149 LINCS
View more database links