(2S,4R)-1-[(2S)-3,3-dimethyl-2-{8-[4-(4-{[8-(phenylamino)-9-[(3S)-1-(prop-2-enoyl)piperidin-3-yl]-9H-purin-2-yl]amino}phenyl)piperazin-1-yl]octanamido}butanoyl]-4-hydroxy-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide, 97%

cas: 2768472-28-0 — see every product listed under this CAS number, including other names

(2S,4R)-1-[(2S)-3,3-dimethyl-2-{8-[4-(4-{[8-(phenylamino)-9-[(3S)-1-(prop-2-enoyl)piperidin-3-yl]-9H-purin-2-yl]amino}phenyl)piperazin-1-yl]octanamido}butanoyl]-4-hydroxy-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide, 97% (CAS 2768472-28-0) is a chemical reagent available from Chemat. Available pack sizes: 1mg. Offered by: Chemat.

• 2D
• 3D

(2S,4R)-1-[(2S)-2-[8-[4-[4-[[8-anilino-9-[(3S)-1-prop-2-enoylpiperidin-3-yl]purin-2-yl]amino]phenyl]piperazin-1-yl]octanoylamino]-3,3-dimethylbutanoyl]-4-hydroxy-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide (CAS 2768472-28-0) is a chemical compound with the molecular formula C60H77N13O5S and a molecular weight of 1092.4 g/mol. IUPAC name: (2S,4R)-1-[(2S)-2-[8-[4-[4-[[8-anilino-9-[(3S)-1-prop-2-enoylpiperidin-3-yl]purin-2-yl]amino]phenyl]piperazin-1-yl]octanoylamino]-3,3-dimethylbutanoyl]-4-hydroxy-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide. InChIKey: RYXQXEGTLNBKEC-DKQRTKIFSA-N.

Identity

Molecular formula	C60H77N13O5S
Molecular weight	1092.4 g/mol
IUPAC name	(2S,4R)-1-[(2S)-2-[8-[4-[4-[[8-anilino-9-[(3S)-1-prop-2-enoylpiperidin-3-yl]purin-2-yl]amino]phenyl]piperazin-1-yl]octanoylamino]-3,3-dimethylbutanoyl]-4-hydroxy-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide
InChIKey	RYXQXEGTLNBKEC-DKQRTKIFSA-N
SMILES	CC1=C(SC=N1)C2=CC=C(C=C2)[C@H](C)NC(=O)[C@@H]3C[C@H](CN3C(=O)[C@H](C(C)(C)C)NC(=O)CCCCCCCN4CCN(CC4)C5=CC=C(C=C5)NC6=NC=C7C(=N6)N(C(=N7)NC8=CC=CC=C8)[C@H]9CCCN(C9)C(=O)C=C)O

Computed by PubChem (NCBI)

Synonyms: PROTAC EGFR degrader 3, PROTAC EGFR Degrader-3, orb1983017