[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [5-(4-chlorophenyl)-1H-pyrazol-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: [5-(4-chlorophenyl)-1H-pyrazol-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [5-(4-chlorophenyl)-1H-pyrazol-4-yl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [5-(4-chlorophenyl)-1H-pyrazol-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: [5-(4-chlorophenyl)-1H-pyrazol-4-yl]-[4-(2-pyrimidyl)piperazino]methanone Formula: C18H17ClN6O MolecularWeight: 368.82018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=C(NN=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=C(NN=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C18H17ClN6O/c19-14-4-2-13(3-5-14)16-15(12-22-23-16)17(26)24-8-10-25(11-9-24)18-20-6-1-7-21-18/h1-7,12H,8-11H2,(H,22,23)