2-(2-chlorophenyl)-5-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-1,3-oxazole-4-carbonitrile

Systemtic Name: 2-(2-chlorophenyl)-5-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-1,3-oxazole-4-carbonitrile Openeye Name: 2-(2-chlorophenyl)-5-[4-(4-fluorobenzoyl)piperazin-1-yl]oxazole-4-carbonitrile CAS Name: 2-(2-chlorophenyl)-5-[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]-4-oxazolecarbonitrile IUPAC Name: 2-(2-chlorophenyl)-5-[4-(4-fluorobenzoyl)piperazin-1-yl]-1,3-oxazole-4-carbonitrile Traditional Name: 2-(2-chlorophenyl)-5-[4-(4-fluorobenzoyl)piperazino]oxazole-4-carbonitrile Formula: C21H16ClFN4O2 MolecularWeight: 410.828743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(N=C(O2)C3=CC=CC=C3Cl)C#N)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1C2=C(N=C(O2)C3=CC=CC=C3Cl)C#N)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H16ClFN4O2/c22-17-4-2-1-3-16(17)19-25-18(13-24)21(29-19)27-11-9-26(10-12-27)20(28)14-5-7-15(23)8-6-14/h1-8H,9-12H2