Products 2490589-12-1

CAS 2490589-12-1 is the registry number for sEH/AChE-IN-4. Offered by: MedChemExpress. Available pack sizes: Get quote.

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

1-[1-[5-[[(1R,13R)-7-chloro-15-methyl-10-azatetracyclo[11.3.1.02,11.04,9]heptadeca-2,4(9),5,7,10,14-hexaen-3-yl]amino]pentanoyl]piperidin-4-yl]-3-[4-(trifluoromethoxy)phenyl]urea (CAS 2490589-12-1) is a chemical compound with the molecular formula C35H39ClF3N5O3 and a molecular weight of 670.2 g/mol. IUPAC name: 1-[1-[5-[[(1R,13R)-7-chloro-15-methyl-10-azatetracyclo[11.3.1.02,11.04,9]heptadeca-2,4(9),5,7,10,14-hexaen-3-yl]amino]pentanoyl]piperidin-4-yl]-3-[4-(trifluoromethoxy)phenyl]urea. InChIKey: VPHLBLQNXMWQOL-PKTZIBPZSA-N.

Identity
Molecular formulaC35H39ClF3N5O3
Molecular weight670.2 g/mol
IUPAC name1-[1-[5-[[(1R,13R)-7-chloro-15-methyl-10-azatetracyclo[11.3.1.02,11.04,9]heptadeca-2,4(9),5,7,10,14-hexaen-3-yl]amino]pentanoyl]piperidin-4-yl]-3-[4-(trifluoromethoxy)phenyl]urea
InChIKeyVPHLBLQNXMWQOL-PKTZIBPZSA-N
SMILESCC1=C[C@@H]2C[C@H](C1)C3=C(C4=C(C=C(C=C4)Cl)N=C3C2)NCCCCC(=O)N5CCC(CC5)NC(=O)NC6=CC=C(C=C6)OC(F)(F)F

Computed by PubChem (NCBI)