CHEBI:95251 - N-[3-(4-methyl-1-piperazinyl)-1,4-dioxo-2-naphthalenyl]benzenesulfonamide

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ChEBI Name N-[3-(4-methyl-1-piperazinyl)-1,4-dioxo-2-naphthalenyl]benzenesulfonamide
ChEBI ID CHEBI:95251
Stars This entity has been manually annotated by a third party.
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Formula C21H21N3O4S
Net Charge 0
Average Mass 411.476
Monoisotopic Mass 411.12528
InChI InChI=1S/C21H21N3O4S/c1-23-11-13-24(14-12-23)19-18(22-29(27,28)15-7-3-2-4-8-15)20(25)16-9-5-6-10-17(16)21(19)26/h2-10,22H,11-14H2,1H3
InChIKey RMPULVLSYIHHQO-UHFFFAOYSA-N
SMILES CN1CCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)NS(=O)(=O)C4=CC=CC=C4
ChEBI Ontology
Outgoing N-[3-(4-methyl-1-piperazinyl)-1,4-dioxo-2-naphthalenyl]benzenesulfonamide (CHEBI:95251) is a 1,4-naphthoquinones (CHEBI:132142)
N-[3-(4-methyl-1-piperazinyl)-1,4-dioxo-2-naphthalenyl]benzenesulfonamide (CHEBI:95251) is a piperazines (CHEBI:26144)
N-[3-(4-methyl-1-piperazinyl)-1,4-dioxo-2-naphthalenyl]benzenesulfonamide (CHEBI:95251) is a sulfonamide (CHEBI:35358)
Manual Xref Database
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Last Modified
07 June 2016