Home/Compounds/Pharmaceutical Intermediate/2-{[(2,6-difluorophenyl)methyl](ethoxycarbonyl)amino}-4-[(dimethylamino)methyl]-5-(4-nitrophenyl)thiophene-3-carboxylic acid
C24H23F2N3O6S
519.5 g/mol
Pharmaceutical IntermediateWarning
2-{[(2,6-difluorophenyl)methyl](ethoxycarbonyl)amino}-4-[(dimethylamino)methyl]-5-(4-nitrophenyl)thiophene-3-carboxylic acid
CAS1589503-95-6EC854-550-9
Category
Pharmaceutical Intermediate
Compound Class
Organic Acid
Primary Use
Pharmaceutical Intermediate
This compound is a thiophene carboxylic acid derivative featuring a 4-nitrophenyl substituent and a difluorobenzyl group. It is primarily utilized as a pharmaceutical intermediate in the manufacturing process of the active pharmaceutical ingredient relugolix.
Pharmaceutical intermediate for relugolix manufacturingBuilding block in organic synthesis of therapeutic candidates
Content scope: Information here supports chemical identification and industrial supply, research, and manufacturing contexts. It is not a therapeutic claim, medical advice, or drug-use instructions.
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CAS 1589503-95-6
Related Compounds
StrongStructure SimilarSimilarity 0.87
Ethyl 2-{[(2,6-difluorophenyl)methyl](ethoxycarbonyl)amino}-4-[(dimethylamino)methyl]-5-(4-nitrophenyl)thiophene-3-carboxylate
CAS1589503-97-8
pharmaceutical intermediate
SimilarStructure SimilarSimilarity 0.80
3-Thiophenecarboxylic acid, 2-[[(2,6-difluorophenyl)methyl][(1-methylethoxy)carbonyl]amino]-4-[(dimethylamino)methyl]-5-(4-nitrophenyl)-
CAS2636079-30-4
pharmaceutical intermediate
SimilarStructure SimilarSimilarity 0.79
3-Thiophenecarboxylic acid, 2-[[(2,6-difluorophenyl)methyl](propoxycarbonyl)amino]-4-[(dimethylamino)methyl]-5-(4-nitrophenyl)-, ethyl ester
CAS2591260-08-9
research compound
SimilarStructure SimilarSimilarity 0.79
Ethyl 2-((2,6-difluorobenzyl)(methoxycarbonyl)amino)-4-((dimethylamino)methyl)-5-(4-nitrophenyl)thiophene-3-carboxylate
CAS2636079-26-8
pharmaceutical intermediate
ReferenceSame Category
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CAS1589503-96-7
pharmaceutical intermediate
ReferenceSame Category
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B-[2-Fluoro-4-(trans-4-propylcyclohexyl)phenyl]-boronic acid
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pharmaceutical intermediate
Safety Reference
Warning
H302Harmful if swallowed
H315Causes skin irritation
H319Causes serious eye irritation
H335May cause respiratory irritation
H351Suspected of causing cancer
Identifiers
IUPAC Name
2-[(2,6-difluorophenyl)methyl-ethoxycarbonylamino]-4-[(dimethylamino)methyl]-5-(4-nitrophenyl)thiophene-3-carboxylic acid
InChIKey
WIZSPFRNLVKEOT-UHFFFAOYSA-N
SMILES
CCOC(=O)N(CC1=C(C=CC=C1F)F)C2=C(C(=C(S2)C3=CC=C(C=C3)[N+](=O)[O-])CN(C)C)C(=O)O
Synonyms (5)
- Relugolix Impurity 187
- Relugolixintermediate5