Produkty 2738533-33-8
CAS 2738533-33-8 to numer rejestracyjny substancji (S)-GNE-987. Oferty producentów: MedChemExpress. Dostępne opakowania: Get quote.
12-(3,5-difluoro-2-pyridinyl)-N-[11-[[(2S)-1-[(2S,4S)-4-hydroxy-2-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methylcarbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-11-oxoundecyl]-4-methyl-8-(methylsulfonylmethyl)-3-oxo-4,12,16-triazatetracyclo[8.6.1.02,7.013,17]heptadeca-1,5,7,9,13(17)-pentaene-9-carboxamide (CAS 2738533-33-8) to związek chemiczny o wzorze sumarycznym C56H69F2N9O8S2 i masie molowej 1098.3 g/mol. Nazwa systematyczna IUPAC: 12-(3,5-difluoro-2-pyridinyl)-N-[11-[[(2S)-1-[(2S,4S)-4-hydroxy-2-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methylcarbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-11-oxoundecyl]-4-methyl-8-(methylsulfonylmethyl)-3-oxo-4,12,16-triazatetracyclo[8.6.1.02,7.013,17]heptadeca-1,5,7,9,13(17)-pentaene-9-carboxamide. InChIKey: BACNODYHHDGTRW-AREMGZRVSA-N.
| Wzór sumaryczny | C56H69F2N9O8S2 |
|---|---|
| Masa molowa | 1098.3 g/mol |
| Nazwa IUPAC | 12-(3,5-difluoro-2-pyridinyl)-N-[11-[[(2S)-1-[(2S,4S)-4-hydroxy-2-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methylcarbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-11-oxoundecyl]-4-methyl-8-(methylsulfonylmethyl)-3-oxo-4,12,16-triazatetracyclo[8.6.1.02,7.013,17]heptadeca-1,5,7,9,13(17)-pentaene-9-carboxamide |
| InChIKey | BACNODYHHDGTRW-AREMGZRVSA-N |
| SMILES | CC1=C(SC=N1)C2=CC=C(C=C2)CNC(=O)[C@@H]3C[C@@H](CN3C(=O)[C@H](C(C)(C)C)NC(=O)CCCCCCCCCCNC(=O)C4=C5CN(C6=C5C(=C7C(=C4CS(=O)(=O)C)C=CN(C7=O)C)NCC6)C8=C(C=C(C=N8)F)F)O |
Dane obliczone przez PubChem (NCBI)