2-[[4-(4-chlorophenyl)piperazin-1-yl]methyl]-3-(4-ethoxyphenyl)quinazolin-4-one

Systemtic Name: 2-[[4-(4-chlorophenyl)piperazin-1-yl]methyl]-3-(4-ethoxyphenyl)quinazolin-4-one Openeye Name: 2-[[4-(4-chlorophenyl)piperazin-1-yl]methyl]-3-(4-ethoxyphenyl)quinazolin-4-one CAS Name: 2-[[4-(4-chlorophenyl)-1-piperazinyl]methyl]-3-(4-ethoxyphenyl)-4-quinazolinone IUPAC Name: 2-[[4-(4-chlorophenyl)piperazin-1-yl]methyl]-3-(4-ethoxyphenyl)quinazolin-4-one Traditional Name: 2-[[4-(4-chlorophenyl)piperazino]methyl]-3-p-phenetyl-quinazolin-4-one Formula: C27H27ClN4O2 MolecularWeight: 474.98188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)CN4CCN(CC4)C5=CC=C(C=C5)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)CN4CCN(CC4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H27ClN4O2/c1-2-34-23-13-11-22(12-14-23)32-26(29-25-6-4-3-5-24(25)27(32)33)19-30-15-17-31(18-16-30)21-9-7-20(28)8-10-21/h3-14H,2,15-19H2,1H3