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

Systemtic Name: 2-(3-chlorophenyl)-5-[4-(3-chlorophenyl)carbonylpiperazin-1-yl]-1,3-oxazole-4-carbonitrile Openeye Name: 5-[4-(3-chlorobenzoyl)piperazin-1-yl]-2-(3-chlorophenyl)oxazole-4-carbonitrile CAS Name: 2-(3-chlorophenyl)-5-[4-[(3-chlorophenyl)-oxomethyl]-1-piperazinyl]-4-oxazolecarbonitrile IUPAC Name: 5-[4-(3-chlorobenzoyl)piperazin-1-yl]-2-(3-chlorophenyl)-1,3-oxazole-4-carbonitrile Traditional Name: 5-[4-(3-chlorobenzoyl)piperazino]-2-(3-chlorophenyl)oxazole-4-carbonitrile Formula: C21H16Cl2N4O2 MolecularWeight: 427.28334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16Cl2N4O2/c22-16-5-1-3-14(11-16)19-25-18(13-24)21(29-19)27-9-7-26(8-10-27)20(28)15-4-2-6-17(23)12-15/h1-6,11-12H,7-10H2