Products 3082412-00-5

CAS 3082412-00-5 is the registry number for KRAS-IN-5. Offered by: MedChemExpress. Available pack sizes: Get quote.

Structural formula: {0} (CAS {1})

(8S)-13-(5-ethyl-6-fluoro-3-methyl-2H-benzo[f]indazol-4-yl)-14-fluoro-17-[[(2R,8S)-2-fluoro-1,2,3,5,6,7-hexahydropyrrolizin-8-yl]methoxy]-6,10-dioxa-2,12,16,18-tetrazatetracyclo[9.7.1.02,8.015,19]nonadeca-1(18),11,13,15(19),16-pentaene (CAS 3082412-00-5) is a chemical compound with the molecular formula C35H36F3N7O3 and a molecular weight of 659.7 g/mol. IUPAC name: (8S)-13-(5-ethyl-6-fluoro-3-methyl-2H-benzo[f]indazol-4-yl)-14-fluoro-17-[[(2R,8S)-2-fluoro-1,2,3,5,6,7-hexahydropyrrolizin-8-yl]methoxy]-6,10-dioxa-2,12,16,18-tetrazatetracyclo[9.7.1.02,8.015,19]nonadeca-1(18),11,13,15(19),16-pentaene. InChIKey: XVMXDENYYVXFTQ-RZGOILFOSA-N.

Identity
Molecular formulaC35H36F3N7O3
Molecular weight659.7 g/mol
IUPAC name(8S)-13-(5-ethyl-6-fluoro-3-methyl-2H-benzo[f]indazol-4-yl)-14-fluoro-17-[[(2R,8S)-2-fluoro-1,2,3,5,6,7-hexahydropyrrolizin-8-yl]methoxy]-6,10-dioxa-2,12,16,18-tetrazatetracyclo[9.7.1.02,8.015,19]nonadeca-1(18),11,13,15(19),16-pentaene
InChIKeyXVMXDENYYVXFTQ-RZGOILFOSA-N
SMILESCCC1=C(C=CC2=CC3=NNC(=C3C(=C21)C4=C(C5=C6C(=NC(=N5)OC[C@@]78CCCN7C[C@@H](C8)F)N9CCCOC[C@H]9COC6=N4)F)C)F

Computed by PubChem (NCBI)

Synonyms: orb3135455