2H-chromen-3-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: 2H-chromen-3-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: 2H-chromen-3-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: 2H-1-benzopyran-3-yl-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: 2H-chromen-3-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: 2H-chromen-3-yl-[4-(2-pyrimidyl)piperazino]methanone Formula: C18H18N4O2 MolecularWeight: 322.36112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC4=CC=CC=C4OC3

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC4=CC=CC=C4OC3

InChI

InChI=1S/C18H18N4O2/c23-17(15-12-14-4-1-2-5-16(14)24-13-15)21-8-10-22(11-9-21)18-19-6-3-7-20-18/h1-7,12H,8-11,13H2