Products 3033641-67-4
CAS 3033641-67-4 is the registry number for KRAS-IN-42. Offered by: MedChemExpress. Available pack sizes: Get quote.
4-[(4R,7S,8S,9S)-17-[[(8S)-7-(difluoromethylidene)-2,3,5,6-tetrahydro-1H-pyrrolizin-8-yl]methoxy]-14-fluoro-9-methyl-10-oxa-2,12,16,18,20-pentazapentacyclo[9.7.1.14,7.02,8.015,19]icosa-1(18),11,13,15(19),16-pentaen-13-yl]-5-ethynyl-6-fluoronaphthalen-2-amine (CAS 3033641-67-4) is a chemical compound with the molecular formula C36H33F4N7O2 and a molecular weight of 671.7 g/mol. IUPAC name: 4-[(4R,7S,8S,9S)-17-[[(8S)-7-(difluoromethylidene)-2,3,5,6-tetrahydro-1H-pyrrolizin-8-yl]methoxy]-14-fluoro-9-methyl-10-oxa-2,12,16,18,20-pentazapentacyclo[9.7.1.14,7.02,8.015,19]icosa-1(18),11,13,15(19),16-pentaen-13-yl]-5-ethynyl-6-fluoronaphthalen-2-amine. InChIKey: SMAWSUMDCLDRFY-RCDCECCNSA-N.
| Molecular formula | C36H33F4N7O2 |
|---|---|
| Molecular weight | 671.7 g/mol |
| IUPAC name | 4-[(4R,7S,8S,9S)-17-[[(8S)-7-(difluoromethylidene)-2,3,5,6-tetrahydro-1H-pyrrolizin-8-yl]methoxy]-14-fluoro-9-methyl-10-oxa-2,12,16,18,20-pentazapentacyclo[9.7.1.14,7.02,8.015,19]icosa-1(18),11,13,15(19),16-pentaen-13-yl]-5-ethynyl-6-fluoronaphthalen-2-amine |
| InChIKey | SMAWSUMDCLDRFY-RCDCECCNSA-N |
| SMILES | C[C@H]1[C@@H]2[C@@H]3CC[C@@H](N3)CN2C4=NC(=NC5=C4C(=NC(=C5F)C6=C7C(=CC(=C6)N)C=CC(=C7C#C)F)O1)OC[C@@]89CCCN8CCC9=C(F)F |
Computed by PubChem (NCBI)
Synonyms:
orb3173568