2-[4-(2-pyridin-3-ylquinazolin-4-yl)piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-(2-pyridin-3-ylquinazolin-4-yl)piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-[2-(3-pyridyl)quinazolin-4-yl]piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[2-(3-pyridinyl)-4-quinazolinyl]-1-piperazinyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-(2-pyridin-3-ylquinazolin-4-yl)piperazin-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-[2-(3-pyridyl)quinazolin-4-yl]piperazino]-1-pyrrolidino-ethanone Formula: C23H26N6O MolecularWeight: 402.49214

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2CCN(CC2)C3=NC(=NC4=CC=CC=C43)C5=CN=CC=C5

Isomeric SMILES

C1CCN(C1)C(=O)CN2CCN(CC2)C3=NC(=NC4=CC=CC=C43)C5=CN=CC=C5

InChI

InChI=1S/C23H26N6O/c30-21(28-10-3-4-11-28)17-27-12-14-29(15-13-27)23-19-7-1-2-8-20(19)25-22(26-23)18-6-5-9-24-16-18/h1-2,5-9,16H,3-4,10-15,17H2