CAS 3033641-67-4 to numer rejestracyjny substancji KRAS-IN-42. Oferty producentów: MedChemExpress. Dostępne opakowania: 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) to związek chemiczny o wzorze sumarycznym C36H33F4N7O2 i masie molowej 671.7 g/mol. Nazwa systematyczna IUPAC: 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.
| Wzór sumaryczny | C36H33F4N7O2 |
|---|---|
| Masa molowa | 671.7 g/mol |
| Nazwa IUPAC | 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 |
Dane obliczone przez PubChem (NCBI)