2-(4-dimethylaminophenyl)-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]quinazolin-4-one

Systemtic Name: 2-(4-dimethylaminophenyl)-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]quinazolin-4-one Openeye Name: 2-(4-dimethylaminophenyl)-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]quinazolin-4-one CAS Name: 2-(4-dimethylaminophenyl)-3-[2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]-4-quinazolinone IUPAC Name: 2-(4-dimethylaminophenyl)-3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]quinazolin-4-one Traditional Name: 2-(4-dimethylaminophenyl)-3-[2-[4-(2-pyrimidyl)piperazino]ethyl]quinazolin-4-one Formula: C26H29N7O MolecularWeight: 455.55476

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)N2CCN4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)N2CCN4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C26H29N7O/c1-30(2)21-10-8-20(9-11-21)24-29-23-7-4-3-6-22(23)25(34)33(24)19-16-31-14-17-32(18-15-31)26-27-12-5-13-28-26/h3-13H,14-19H2,1-2H3