5-[4-(diphenylmethyl)piperazin-1-yl]-2-[(2-fluoranylphenoxy)methyl]-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-[4-(diphenylmethyl)piperazin-1-yl]-2-[(2-fluoranylphenoxy)methyl]-1,3-oxazole-4-carbonitrile Openeye Name: 5-(4-benzhydrylpiperazin-1-yl)-2-[(2-fluorophenoxy)methyl]oxazole-4-carbonitrile CAS Name: 5-[4-(diphenylmethyl)-1-piperazinyl]-2-[(2-fluorophenoxy)methyl]-4-oxazolecarbonitrile IUPAC Name: 5-(4-benzhydrylpiperazin-1-yl)-2-[(2-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile Traditional Name: 5-(4-benzhydrylpiperazino)-2-[(2-fluorophenoxy)methyl]oxazole-4-carbonitrile Formula: C28H25FN4O2 MolecularWeight: 468.522103

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(N=C(O2)COC3=CC=CC=C3F)C#N)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=C(N=C(O2)COC3=CC=CC=C3F)C#N)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H25FN4O2/c29-23-13-7-8-14-25(23)34-20-26-31-24(19-30)28(35-26)33-17-15-32(16-18-33)27(21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-14,27H,15-18,20H2