CHEBI:105570 - N-[2-(2,3-dimethylphenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-methoxybenzamide

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ChEBI Name N-[2-(2,3-dimethylphenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-methoxybenzamide
ChEBI ID CHEBI:105570
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/c1-13-7-6-9-18(14(13)2)24-20(16-11-29(26,27)12-17(16)23-24)22-21(25)15-8-4-5-10-19(15)28-3/h4-10H,11-12H2,1-3H3,(H,22,25)
InChIKey GHWBFHGCWMTBRS-UHFFFAOYSA-N
SMILES CC1=C(C(=CC=C1)N2C(=C3CS(=O)(=O)CC3=N2)NC(=O)C4=CC=CC=C4OC)C
ChEBI Ontology
Outgoing N-[2-(2,3-dimethylphenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-methoxybenzamide (CHEBI:105570) is a pyrazoles (CHEBI:26410)
N-[2-(2,3-dimethylphenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-methoxybenzamide (CHEBI:105570) is a ring assembly (CHEBI:36820)
Manual Xref Database
LSM-16933 LINCS
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