5-[4-(3-chlorophenyl)piperazin-1-yl]-2-(phenoxymethyl)-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-[4-(3-chlorophenyl)piperazin-1-yl]-2-(phenoxymethyl)-1,3-oxazole-4-carbonitrile Openeye Name: 5-[4-(3-chlorophenyl)piperazin-1-yl]-2-(phenoxymethyl)oxazole-4-carbonitrile CAS Name: 5-[4-(3-chlorophenyl)-1-piperazinyl]-2-(phenoxymethyl)-4-oxazolecarbonitrile IUPAC Name: 5-[4-(3-chlorophenyl)piperazin-1-yl]-2-(phenoxymethyl)-1,3-oxazole-4-carbonitrile Traditional Name: 5-[4-(3-chlorophenyl)piperazino]-2-(phenoxymethyl)oxazole-4-carbonitrile Formula: C21H19ClN4O2 MolecularWeight: 394.85416

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(N=C(O3)COC4=CC=CC=C4)C#N

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(N=C(O3)COC4=CC=CC=C4)C#N

InChI

InChI=1S/C21H19ClN4O2/c22-16-5-4-6-17(13-16)25-9-11-26(12-10-25)21-19(14-23)24-20(28-21)15-27-18-7-2-1-3-8-18/h1-8,13H,9-12,15H2