3-[3-(2-tert-butyl-4-methyl-phenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4-one

Systemtic Name: 3-[3-(2-tert-butyl-4-methyl-phenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4-one Openeye Name: 3-[3-(2-tert-butyl-4-methyl-phenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4-one CAS Name: 3-[3-(2-tert-butyl-4-methylphenoxy)propyl]-2-(4-methoxyphenyl)-4-quinazolinone IUPAC Name: 3-[3-(2-tert-butyl-4-methylphenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4-one Traditional Name: 3-[3-(2-tert-butyl-4-methyl-phenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4-one Formula: C29H32N2O3 MolecularWeight: 456.57598

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H32N2O3/c1-20-11-16-26(24(19-20)29(2,3)4)34-18-8-17-31-27(21-12-14-22(33-5)15-13-21)30-25-10-7-6-9-23(25)28(31)32/h6-7,9-16,19H,8,17-18H2,1-5H3