2-(4-chlorophenyl)-3-[5-(2,6-dimethylphenoxy)pentyl]quinazolin-4-one

Systemtic Name: 2-(4-chlorophenyl)-3-[5-(2,6-dimethylphenoxy)pentyl]quinazolin-4-one Openeye Name: 2-(4-chlorophenyl)-3-[5-(2,6-dimethylphenoxy)pentyl]quinazolin-4-one CAS Name: 2-(4-chlorophenyl)-3-[5-(2,6-dimethylphenoxy)pentyl]-4-quinazolinone IUPAC Name: 2-(4-chlorophenyl)-3-[5-(2,6-dimethylphenoxy)pentyl]quinazolin-4-one Traditional Name: 2-(4-chlorophenyl)-3-[5-(2,6-dimethylphenoxy)pentyl]quinazolin-4-one Formula: C27H27ClN2O2 MolecularWeight: 446.96848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCCCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C27H27ClN2O2/c1-19-9-8-10-20(2)25(19)32-18-7-3-6-17-30-26(21-13-15-22(28)16-14-21)29-24-12-5-4-11-23(24)27(30)31/h4-5,8-16H,3,6-7,17-18H2,1-2H3