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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C3=C(N=C(O3)C4=CC(=CC=C4)Cl)C#N

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C3=C(N=C(O3)C4=CC(=CC=C4)Cl)C#N

InChI

InChI=1S/C21H19ClN4O2/c1-27-18-7-5-17(6-8-18)25-9-11-26(12-10-25)21-19(14-23)24-20(28-21)15-3-2-4-16(22)13-15/h2-8,13H,9-12H2,1H3