[1-(3-chlorophenyl)-5-ethyl-pyrazol-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [1-(3-chlorophenyl)-5-ethyl-pyrazol-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: [1-(3-chlorophenyl)-5-ethyl-pyrazol-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [1-(3-chlorophenyl)-5-ethyl-4-pyrazolyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [1-(3-chlorophenyl)-5-ethylpyrazol-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: [1-(3-chlorophenyl)-5-ethyl-pyrazol-4-yl]-[4-(2-pyrimidyl)piperazino]methanone Formula: C20H21ClN6O MolecularWeight: 396.87334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CCC1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C20H21ClN6O/c1-2-18-17(14-24-27(18)16-6-3-5-15(21)13-16)19(28)25-9-11-26(12-10-25)20-22-7-4-8-23-20/h3-8,13-14H,2,9-12H2,1H3