Products 3030078-96-4

CAS 3030078-96-4 is the registry number for KRAS inhibitor-35. Offered by: MedChemExpress. Available pack sizes: Get quote.

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

(Z)-1-[4-[7-(8-ethynyl-7-fluoro-3-hydroxynaphthalen-1-yl)-8-fluoro-2-[[(2R,8S)-2-fluoro-1,2,3,5,6,7-hexahydropyrrolizin-8-yl]methoxy]quinazolin-4-yl]piperazin-1-yl]-2-fluoro-3-(1,3-thiazol-2-yl)prop-2-en-1-one (CAS 3030078-96-4) is a chemical compound with the molecular formula C38H32F4N6O3S and a molecular weight of 728.8 g/mol. IUPAC name: (Z)-1-[4-[7-(8-ethynyl-7-fluoro-3-hydroxynaphthalen-1-yl)-8-fluoro-2-[[(2R,8S)-2-fluoro-1,2,3,5,6,7-hexahydropyrrolizin-8-yl]methoxy]quinazolin-4-yl]piperazin-1-yl]-2-fluoro-3-(1,3-thiazol-2-yl)prop-2-en-1-one. InChIKey: CWHVFJVDEXMKCQ-ABVXXMDOSA-N.

Identity
Molecular formulaC38H32F4N6O3S
Molecular weight728.8 g/mol
IUPAC name(Z)-1-[4-[7-(8-ethynyl-7-fluoro-3-hydroxynaphthalen-1-yl)-8-fluoro-2-[[(2R,8S)-2-fluoro-1,2,3,5,6,7-hexahydropyrrolizin-8-yl]methoxy]quinazolin-4-yl]piperazin-1-yl]-2-fluoro-3-(1,3-thiazol-2-yl)prop-2-en-1-one
InChIKeyCWHVFJVDEXMKCQ-ABVXXMDOSA-N
SMILESC#CC1=C(C=CC2=CC(=CC(=C21)C3=C(C4=C(C=C3)C(=NC(=N4)OC[C@@]56CCCN5C[C@@H](C6)F)N7CCN(CC7)C(=O)/C(=C/C8=NC=CS8)/F)F)O)F

Computed by PubChem (NCBI)

Synonyms: orb2665086