2-(4-phenylmethoxyphenyl)-5-[4-(phenylmethyl)piperazin-1-yl]-1,3-oxazole-4-carbonitrile

Systemtic Name: 2-(4-phenylmethoxyphenyl)-5-[4-(phenylmethyl)piperazin-1-yl]-1,3-oxazole-4-carbonitrile Openeye Name: 2-(4-benzyloxyphenyl)-5-(4-benzylpiperazin-1-yl)oxazole-4-carbonitrile CAS Name: 2-(4-phenylmethoxyphenyl)-5-[4-(phenylmethyl)-1-piperazinyl]-4-oxazolecarbonitrile IUPAC Name: 5-(4-benzylpiperazin-1-yl)-2-(4-phenylmethoxyphenyl)-1,3-oxazole-4-carbonitrile Traditional Name: 2-(4-benzoxyphenyl)-5-(4-benzylpiperazino)oxazole-4-carbonitrile Formula: C28H26N4O2 MolecularWeight: 450.53164

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=C(N=C(O3)C4=CC=C(C=C4)OCC5=CC=CC=C5)C#N

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=C(N=C(O3)C4=CC=C(C=C4)OCC5=CC=CC=C5)C#N

InChI

InChI=1S/C28H26N4O2/c29-19-26-28(32-17-15-31(16-18-32)20-22-7-3-1-4-8-22)34-27(30-26)24-11-13-25(14-12-24)33-21-23-9-5-2-6-10-23/h1-14H,15-18,20-21H2