3-[2-(2-tert-butyl-4-methyl-phenoxy)ethyl]-2-(4-chlorophenyl)quinazolin-4-one

Systemtic Name: 3-[2-(2-tert-butyl-4-methyl-phenoxy)ethyl]-2-(4-chlorophenyl)quinazolin-4-one Openeye Name: 3-[2-(2-tert-butyl-4-methyl-phenoxy)ethyl]-2-(4-chlorophenyl)quinazolin-4-one CAS Name: 3-[2-(2-tert-butyl-4-methylphenoxy)ethyl]-2-(4-chlorophenyl)-4-quinazolinone IUPAC Name: 3-[2-(2-tert-butyl-4-methylphenoxy)ethyl]-2-(4-chlorophenyl)quinazolin-4-one Traditional Name: 3-[2-(2-tert-butyl-4-methyl-phenoxy)ethyl]-2-(4-chlorophenyl)quinazolin-4-one Formula: C27H27ClN2O2 MolecularWeight: 446.96848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)Cl)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)Cl)C(C)(C)C

InChI

InChI=1S/C27H27ClN2O2/c1-18-9-14-24(22(17-18)27(2,3)4)32-16-15-30-25(19-10-12-20(28)13-11-19)29-23-8-6-5-7-21(23)26(30)31/h5-14,17H,15-16H2,1-4H3