2-[4-[4-cyano-2-(furan-2-yl)-1,3-oxazol-5-yl]piperazin-1-ium-1-yl]-N-(3-cyanophenyl)ethanamide

Systemtic Name: 2-[4-[4-cyano-2-(furan-2-yl)-1,3-oxazol-5-yl]piperazin-1-ium-1-yl]-N-(3-cyanophenyl)ethanamide Openeye Name: 2-[4-[4-cyano-2-(2-furyl)oxazol-5-yl]piperazin-1-ium-1-yl]-N-(3-cyanophenyl)acetamide CAS Name: 2-[4-[4-cyano-2-(2-furanyl)-5-oxazolyl]-1-piperazin-1-iumyl]-N-(3-cyanophenyl)acetamide IUPAC Name: 2-[4-[4-cyano-2-(furan-2-yl)-1,3-oxazol-5-yl]piperazin-1-ium-1-yl]-N-(3-cyanophenyl)acetamide Traditional Name: 2-[4-[4-cyano-2-(2-furyl)oxazol-5-yl]piperazin-1-ium-1-yl]-N-(3-cyanophenyl)acetamide Formula: C21H19N6O3+ MolecularWeight: 403.41396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC=CC(=C2)C#N)C3=C(N=C(O3)C4=CC=CO4)C#N

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=CC(=C2)C#N)C3=C(N=C(O3)C4=CC=CO4)C#N

InChI

InChI=1S/C21H18N6O3/c22-12-15-3-1-4-16(11-15)24-19(28)14-26-6-8-27(9-7-26)21-17(13-23)25-20(30-21)18-5-2-10-29-18/h1-5,10-11H,6-9,14H2,(H,24,28)/p+1