2-(4-chlorophenyl)-3-[4-(5-methyl-2-propan-2-yl-phenoxy)butyl]quinazolin-4-one

Systemtic Name: 2-(4-chlorophenyl)-3-[4-(5-methyl-2-propan-2-yl-phenoxy)butyl]quinazolin-4-one Openeye Name: 2-(4-chlorophenyl)-3-[4-(2-isopropyl-5-methyl-phenoxy)butyl]quinazolin-4-one CAS Name: 2-(4-chlorophenyl)-3-[4-(5-methyl-2-propan-2-ylphenoxy)butyl]-4-quinazolinone IUPAC Name: 2-(4-chlorophenyl)-3-[4-(5-methyl-2-propan-2-ylphenoxy)butyl]quinazolin-4-one Traditional Name: 2-(4-chlorophenyl)-3-[4-(2-isopropyl-5-methyl-phenoxy)butyl]quinazolin-4-one Formula: C28H29ClN2O2 MolecularWeight: 460.99506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H29ClN2O2/c1-19(2)23-15-10-20(3)18-26(23)33-17-7-6-16-31-27(21-11-13-22(29)14-12-21)30-25-9-5-4-8-24(25)28(31)32/h4-5,8-15,18-19H,6-7,16-17H2,1-3H3