5-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]-3-pyridin-2-yl-4,5-dihydro-1,2-oxazole

Systemtic Name: 5-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]-3-pyridin-2-yl-4,5-dihydro-1,2-oxazole Openeye Name: 5-[4-(4-benzylpiperazin-1-yl)phenyl]-3-(2-pyridyl)-4,5-dihydroisoxazole CAS Name: 5-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]-3-(2-pyridinyl)-4,5-dihydroisoxazole IUPAC Name: 5-[4-(4-benzylpiperazin-1-yl)phenyl]-3-pyridin-2-yl-4,5-dihydro-1,2-oxazole Traditional Name: 5-[4-(4-benzylpiperazino)phenyl]-3-(2-pyridyl)-2-isoxazoline Formula: C25H26N4O MolecularWeight: 398.50014

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C=C3)C4CC(=NO4)C5=CC=CC=N5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C=C3)C4CC(=NO4)C5=CC=CC=N5

InChI

InChI=1S/C25H26N4O/c1-2-6-20(7-3-1)19-28-14-16-29(17-15-28)22-11-9-21(10-12-22)25-18-24(27-30-25)23-8-4-5-13-26-23/h1-13,25H,14-19H2