Products 2694871-86-6

CAS 2694871-86-6 appears in our catalog under these names: BLK–IN–2, BLK-IN-2, 98.61%, BLK-IN-2, 98%. Offered by: GLPBio, MedChemExpress, Chemat. Available pack sizes: 10mg, 5mg, 10mM/1mL, 100 mg, 10 mg, 5 mg, 50 mg, 25 mg.

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

N-[3-[[2-[3-[[1-[(E)-4-(dimethylamino)but-2-enoyl]piperidin-4-yl]amino]anilino]pyrimidin-5-yl]carbamoyl]-4-methylphenyl]isoquinoline-6-carboxamide (CAS 2694871-86-6) is a chemical compound with the molecular formula C39H41N9O3 and a molecular weight of 683.8 g/mol. IUPAC name: N-[3-[[2-[3-[[1-[(E)-4-(dimethylamino)but-2-enoyl]piperidin-4-yl]amino]anilino]pyrimidin-5-yl]carbamoyl]-4-methylphenyl]isoquinoline-6-carboxamide. InChIKey: AWZWOMPLEBTAGQ-VMPITWQZSA-N.

Identity
Molecular formulaC39H41N9O3
Molecular weight683.8 g/mol
IUPAC nameN-[3-[[2-[3-[[1-[(E)-4-(dimethylamino)but-2-enoyl]piperidin-4-yl]amino]anilino]pyrimidin-5-yl]carbamoyl]-4-methylphenyl]isoquinoline-6-carboxamide
InChIKeyAWZWOMPLEBTAGQ-VMPITWQZSA-N
SMILESCC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)C=NC=C3)C(=O)NC4=CN=C(N=C4)NC5=CC(=CC=C5)NC6CCN(CC6)C(=O)/C=C/CN(C)C

Computed by PubChem (NCBI)