CAS: 2050038-81-6 - Phenylmethyl (3R,4S)-3-[2-[(ethoxycarbonyl)[5-[(4-methylphenyl)sulfonyl]-5H-pyrrolo[2,3-b]pyrazin-2-yl]amino]acetyl]-4-ethyl-1-pyrrolidinecarboxylate

Formule : 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

Code InChI : InChIKey=ITDMYESIPHGZCQ-RSXGOPAZSA-N

SMILES : O=C(OCC)N(C1=NC=2C=CN(C2N=C1)S(=O)(=O)C3=CC=C(C=C3)C)CC(=O)C4CN(C(=O)OCC=5C=CC=CC5)CC4CC

Synonymes :

• 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)-

Upadacitinib Impurity 39

CAS : 2050038-81-6

• Formule : C₃₂H₃₅N₅O₇S
• Masse moléculaire : 633.72