CHEBI:107511 - N4,N4-dimethyl-N1-(4-nitro-1,1-dioxo-2,5-dihydrothiophen-3-yl)benzene-1,4-diamine

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ChEBI Name N4,N4-dimethyl-N1-(4-nitro-1,1-dioxo-2,5-dihydrothiophen-3-yl)benzene-1,4-diamine
ChEBI ID CHEBI:107511
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C12H15N3O4S
Net Charge 0
Average Mass 297.332
Monoisotopic Mass 297.07833
InChI InChI=1S/C12H15N3O4S/c1-14(2)10-5-3-9(4-6-10)13-11-7-20(18,19)8-12(11)15(16)17/h3-6,13H,7-8H2,1-2H3
InChIKey OHWVTHZEJBUEKL-UHFFFAOYSA-N
SMILES CN(C)C1=CC=C(C=C1)NC2=C(CS(=O)(=O)C2)[N+](=O)[O-]
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 N4,N4-dimethyl-N1-(4-nitro-1,1-dioxo-2,5-dihydrothiophen-3-yl)benzene-1,4-diamine (CHEBI:107511) is a dialkylarylamine (CHEBI:23665)
N4,N4-dimethyl-N1-(4-nitro-1,1-dioxo-2,5-dihydrothiophen-3-yl)benzene-1,4-diamine (CHEBI:107511) is a tertiary amino compound (CHEBI:50996)
Manual Xref Database
LSM-18867 LINCS
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