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

Systemtic Name: 5-[4-(diphenylmethyl)piperazin-1-yl]-2-[(3-methylphenoxy)methyl]-1,3-oxazole-4-carbonitrile Openeye Name: 5-(4-benzhydrylpiperazin-1-yl)-2-[(3-methylphenoxy)methyl]oxazole-4-carbonitrile CAS Name: 5-[4-(diphenylmethyl)-1-piperazinyl]-2-[(3-methylphenoxy)methyl]-4-oxazolecarbonitrile IUPAC Name: 5-(4-benzhydrylpiperazin-1-yl)-2-[(3-methylphenoxy)methyl]-1,3-oxazole-4-carbonitrile Traditional Name: 5-(4-benzhydrylpiperazino)-2-[(3-methylphenoxy)methyl]oxazole-4-carbonitrile Formula: C29H28N4O2 MolecularWeight: 464.55822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC2=NC(=C(O2)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C#N

Isomeric SMILES

CC1=CC(=CC=C1)OCC2=NC(=C(O2)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C#N

InChI

InChI=1S/C29H28N4O2/c1-22-9-8-14-25(19-22)34-21-27-31-26(20-30)29(35-27)33-17-15-32(16-18-33)28(23-10-4-2-5-11-23)24-12-6-3-7-13-24/h2-14,19,28H,15-18,21H2,1H3