3-(phenylmethyl)-2-[1-[4-(pyridin-2-ylmethyl)piperazin-1-yl]propyl]quinazolin-4-one

Systemtic Name: 3-(phenylmethyl)-2-[1-[4-(pyridin-2-ylmethyl)piperazin-1-yl]propyl]quinazolin-4-one Openeye Name: 3-benzyl-2-[1-[4-(2-pyridylmethyl)piperazin-1-yl]propyl]quinazolin-4-one CAS Name: 3-(phenylmethyl)-2-[1-[4-(2-pyridinylmethyl)-1-piperazinyl]propyl]-4-quinazolinone IUPAC Name: 3-benzyl-2-[1-[4-(pyridin-2-ylmethyl)piperazin-1-yl]propyl]quinazolin-4-one Traditional Name: 3-benzyl-2-[1-[4-(2-pyridylmethyl)piperazino]propyl]quinazolin-4-one Formula: C28H31N5O MolecularWeight: 453.57864

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=CC=CC=C2C(=O)N1CC3=CC=CC=C3)N4CCN(CC4)CC5=CC=CC=N5

Isomeric SMILES

CCC(C1=NC2=CC=CC=C2C(=O)N1CC3=CC=CC=C3)N4CCN(CC4)CC5=CC=CC=N5

InChI

InChI=1S/C28H31N5O/c1-2-26(32-18-16-31(17-19-32)21-23-12-8-9-15-29-23)27-30-25-14-7-6-13-24(25)28(34)33(27)20-22-10-4-3-5-11-22/h3-15,26H,2,16-21H2,1H3