Products 2087490-46-6

CAS 2087490-46-6 is the registry number for ERK-CLIPTAC. Offered by: MedChemExpress. Available pack sizes: Get quote.

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

[1-[4-[[6-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyhexanoylamino]methyl]phenyl]-4-methyl-3,5,6,7,8,9,10,10a-octahydrocycloocta[d]pyridazin-7-yl] N-[4-[4-[[5-chloro-4-[2-(prop-2-enoylamino)anilino]pyrimidin-2-yl]amino]-2-pyridinyl]but-3-ynyl]carbamate (CAS 2087490-46-6) is a chemical compound with the molecular formula C60H61ClN12O9 and a molecular weight of 1129.7 g/mol. IUPAC name: [1-[4-[[6-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyhexanoylamino]methyl]phenyl]-4-methyl-3,5,6,7,8,9,10,10a-octahydrocycloocta[d]pyridazin-7-yl] N-[4-[4-[[5-chloro-4-[2-(prop-2-enoylamino)anilino]pyrimidin-2-yl]amino]-2-pyridinyl]but-3-ynyl]carbamate. InChIKey: AMIFRHOXPKNCKE-UHFFFAOYSA-N.

Identity
Molecular formulaC60H61ClN12O9
Molecular weight1129.7 g/mol
IUPAC name[1-[4-[[6-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyhexanoylamino]methyl]phenyl]-4-methyl-3,5,6,7,8,9,10,10a-octahydrocycloocta[d]pyridazin-7-yl] N-[4-[4-[[5-chloro-4-[2-(prop-2-enoylamino)anilino]pyrimidin-2-yl]amino]-2-pyridinyl]but-3-ynyl]carbamate
InChIKeyAMIFRHOXPKNCKE-UHFFFAOYSA-N
SMILESCC1=C2CCC(CCCC2C(=NN1)C3=CC=C(C=C3)CNC(=O)CCCCCOC4=CC=CC5=C4C(=O)N(C5=O)C6CCC(=O)NC6=O)OC(=O)NCCC#CC7=NC=CC(=C7)NC8=NC=C(C(=N8)NC9=CC=CC=C9NC(=O)C=C)Cl

Computed by PubChem (NCBI)

Synonyms: ERK-CLIPTAC, orb1942323