N-[3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanoylamino]phenyl]furan-2-carboxamide

Systemtic Name: N-[3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanoylamino]phenyl]furan-2-carboxamide Openeye Name: N-[3-[[2-(4-pyrimidin-2-ylpiperazin-1-yl)acetyl]amino]phenyl]furan-2-carboxamide CAS Name: N-[3-[[1-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[3-[[2-(4-pyrimidin-2-ylpiperazin-1-yl)acetyl]amino]phenyl]furan-2-carboxamide Traditional Name: N-[3-[[2-[4-(2-pyrimidyl)piperazino]acetyl]amino]phenyl]-2-furamide Formula: C21H22N6O3 MolecularWeight: 406.43778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=CO3)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCN1CC(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=CO3)C4=NC=CC=N4

InChI

InChI=1S/C21H22N6O3/c28-19(15-26-9-11-27(12-10-26)21-22-7-3-8-23-21)24-16-4-1-5-17(14-16)25-20(29)18-6-2-13-30-18/h1-8,13-14H,9-12,15H2,(H,24,28)(H,25,29)