4-[4-(2-fluorophenyl)piperazin-1-yl]-2-(3,4,5-trimethoxyphenyl)quinazoline

Systemtic Name: 4-[4-(2-fluorophenyl)piperazin-1-yl]-2-(3,4,5-trimethoxyphenyl)quinazoline Openeye Name: 4-[4-(2-fluorophenyl)piperazin-1-yl]-2-(3,4,5-trimethoxyphenyl)quinazoline CAS Name: 4-[4-(2-fluorophenyl)-1-piperazinyl]-2-(3,4,5-trimethoxyphenyl)quinazoline IUPAC Name: 4-[4-(2-fluorophenyl)piperazin-1-yl]-2-(3,4,5-trimethoxyphenyl)quinazoline Traditional Name: 4-[4-(2-fluorophenyl)piperazino]-2-(3,4,5-trimethoxyphenyl)quinazoline Formula: C27H27FN4O3 MolecularWeight: 474.526683

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NC3=CC=CC=C3C(=N2)N4CCN(CC4)C5=CC=CC=C5F

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NC3=CC=CC=C3C(=N2)N4CCN(CC4)C5=CC=CC=C5F

InChI

InChI=1S/C27H27FN4O3/c1-33-23-16-18(17-24(34-2)25(23)35-3)26-29-21-10-6-4-8-19(21)27(30-26)32-14-12-31(13-15-32)22-11-7-5-9-20(22)28/h4-11,16-17H,12-15H2,1-3H3