3-[3-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4-one

Systemtic Name: 3-[3-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4-one Openeye Name: 3-[3-(2-bromo-6-chloro-4-methyl-phenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4-one CAS Name: 3-[3-(2-bromo-6-chloro-4-methylphenoxy)propyl]-2-(4-methoxyphenyl)-4-quinazolinone IUPAC Name: 3-[3-(2-bromo-6-chloro-4-methylphenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4-one Traditional Name: 3-[3-(2-bromo-6-chloro-4-methyl-phenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4-one Formula: C25H22BrClN2O3 MolecularWeight: 513.81078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)OC)Cl

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)OC)Cl

InChI

InChI=1S/C25H22BrClN2O3/c1-16-14-20(26)23(21(27)15-16)32-13-5-12-29-24(17-8-10-18(31-2)11-9-17)28-22-7-4-3-6-19(22)25(29)30/h3-4,6-11,14-15H,5,12-13H2,1-2H3