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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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