3-[4-(2-bromanyl-4,6-dimethyl-phenoxy)butyl]-2-(4-chlorophenyl)quinazolin-4-one

Systemtic Name: 3-[4-(2-bromanyl-4,6-dimethyl-phenoxy)butyl]-2-(4-chlorophenyl)quinazolin-4-one Openeye Name: 3-[4-(2-bromo-4,6-dimethyl-phenoxy)butyl]-2-(4-chlorophenyl)quinazolin-4-one CAS Name: 3-[4-(2-bromo-4,6-dimethylphenoxy)butyl]-2-(4-chlorophenyl)-4-quinazolinone IUPAC Name: 3-[4-(2-bromo-4,6-dimethylphenoxy)butyl]-2-(4-chlorophenyl)quinazolin-4-one Traditional Name: 3-[4-(2-bromo-4,6-dimethyl-phenoxy)butyl]-2-(4-chlorophenyl)quinazolin-4-one Formula: C26H24BrClN2O2 MolecularWeight: 511.83796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)Cl)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C26H24BrClN2O2/c1-17-15-18(2)24(22(27)16-17)32-14-6-5-13-30-25(19-9-11-20(28)12-10-19)29-23-8-4-3-7-21(23)26(30)31/h3-4,7-12,15-16H,5-6,13-14H2,1-2H3