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CAS 2050038-81-6

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Phenylmethyl (3R,4S)-3-[2-[(ethoxycarbonyl)[5-[(4-methylphenyl)sulfonyl]-5H-pyrrolo[2,3-b]pyrazin-2-yl]amino]acetyl]-4-ethyl-1-pyrrolidinecarboxylate

Description:
Phenylmethyl (3R,4S)-3-[2-[(ethoxycarbonyl)[5-[(4-methylphenyl)sulfonyl]-5H-pyrrolo[2,3-b]pyrazin-2-yl]amino]acetyl]-4-ethyl-1-pyrrolidinecarboxylate, identified by its CAS number 2050038-81-6, is a complex organic compound characterized by its multi-functional structure. It features a pyrrolidine backbone, which is a five-membered nitrogen-containing ring, and incorporates various substituents that contribute to its chemical properties. The presence of an ethoxycarbonyl group suggests potential reactivity in esterification or hydrolysis reactions. Additionally, the sulfonyl group attached to the pyrrolo[2,3-b]pyrazine moiety indicates that the compound may exhibit significant biological activity, possibly as a pharmaceutical agent. The stereochemistry denoted by (3R,4S) indicates specific spatial arrangements of atoms, which can influence the compound's interactions with biological targets. Overall, this compound's intricate structure and functional groups suggest potential applications in medicinal chemistry, particularly in the development of targeted therapies or as a lead compound for further drug development.
Formula:C32H35N5O7S
InChI:InChI=1S/C32H35N5O7S/c1-4-24-18-35(31(39)44-21-23-9-7-6-8-10-23)19-26(24)28(38)20-36(32(40)43-5-2)29-17-33-30-27(34-29)15-16-37(30)45(41,42)25-13-11-22(3)12-14-25/h6-17,24,26H,4-5,18-21H2,1-3H3/t24-,26+/m1/s1
InChI key:InChIKey=ITDMYESIPHGZCQ-RSXGOPAZSA-N
SMILES:S(=O)(=O)(N1C=2C(=NC(N(CC(=O)[C@@H]3[C@H](CC)CN(C(OCC4=CC=CC=C4)=O)C3)C(OCC)=O)=CN2)C=C1)C5=CC=C(C)C=C5
Synonyms:
  • Phenylmethyl (3R,4S)-3-[2-[(ethoxycarbonyl)[5-[(4-methylphenyl)sulfonyl]-5H-pyrrolo[2,3-b]pyrazin-2-yl]amino]acetyl]-4-ethyl-1-pyrrolidinecarboxylate
  • 1-Pyrrolidinecarboxylic acid, 3-[2-[(ethoxycarbonyl)[5-[(4-methylphenyl)sulfonyl]-5H-pyrrolo[2,3-b]pyrazin-2-yl]amino]acetyl]-4-ethyl-, phenylmethyl ester, (3R,4S)-
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