CAS 90505-36-5

(4-Nitrophenyl)methyl N-[1-[(3S)-3-mercapto-1-pyrrolidinyl]ethylidene]carbamate

Description:

(4-Nitrophenyl)methyl N-[1-[(3S)-3-mercapto-1-pyrrolidinyl]ethylidene]carbamate, with the CAS number 90505-36-5, is a chemical compound that features a complex structure characterized by the presence of a nitrophenyl group, a pyrrolidine moiety, and a carbamate functional group. This compound is likely to exhibit properties typical of carbamates, such as potential biological activity, including enzyme inhibition or modulation, due to the presence of the mercapto group which can participate in nucleophilic reactions. The nitrophenyl group may contribute to its electronic properties, potentially influencing its reactivity and interaction with biological targets. Additionally, the stereochemistry indicated by the (3S) configuration suggests that the compound may exhibit specific spatial orientation, which can affect its pharmacological profile. Overall, this compound may be of interest in medicinal chemistry and pharmacology, particularly in the development of therapeutic agents targeting specific biological pathways. However, detailed studies would be necessary to fully elucidate its properties and potential applications.

Formula: C₁₄H₁₇N₃O₄S

InChI: InChI=1S/C14H17N3O4S/c1-10(16-7-6-13(22)8-16)15-14(18)21-9-11-2-4-12(5-3-11)17(19)20/h2-5,13,22H,6-9H2,1H3/t13-/m0/s1

InChI key: InChIKey=ZQWBMXVEMVZOQI-ZDUSSCGKSA-N

SMILES: C(=NC(OCC1=CC=C(N(=O)=O)C=C1)=O)(C)N2CC[C@H](S)C2

Synonyms:

• (4-Nitrophenyl)methyl N-[1-[(3S)-3-mercapto-1-pyrrolidinyl]ethylidene]carbamate
• (S)-P1-(3-Mercapto-1-Pyrrolidinyl)Ethylidene]-(4-Nitrophenyl)Methyl Ester, Carbamic Acid
• (S)-[1-(3-mercapto-1-pyrrolidinyl)-ethylidene]-(4-nitrophenyl)methylester,carbamicacid
• Carbamic acid, N-[1-[(3S)-3-mercapto-1-pyrrolidinyl]ethylidene]-, (4-nitrophenyl)methyl ester
• Carbamic acid, [1-(3-mercapto-1-pyrrolidinyl)ethylidene]-, (4-nitrophenyl)methyl ester, (S)-
• S-(1-(1-((((4-nitrobenzyl)oxy)carbonyl)imino)ethyl)pyrrolidin-3-yl) ethanethioate 4-Nitrobenzyl-1-((S)-3-mercaptopyrrolidin-1-yl)ethylidenecarbamate
• Side chain for penipenem