[4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)phenyl]-(4-pyrazin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)phenyl]-(4-pyrazin-2-ylpiperazin-1-yl)methanone Openeye Name: [4-(4-bromo-3,5-dimethyl-pyrazol-1-yl)phenyl]-(4-pyrazin-2-ylpiperazin-1-yl)methanone CAS Name: [4-(4-bromo-3,5-dimethyl-1-pyrazolyl)phenyl]-[4-(2-pyrazinyl)-1-piperazinyl]methanone IUPAC Name: [4-(4-bromo-3,5-dimethylpyrazol-1-yl)phenyl]-(4-pyrazin-2-ylpiperazin-1-yl)methanone Traditional Name: [4-(4-bromo-3,5-dimethyl-pyrazol-1-yl)phenyl]-(4-pyrazin-2-ylpiperazino)methanone Formula: C20H21BrN6O MolecularWeight: 441.32434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC=CN=C4)C)Br

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC=CN=C4)C)Br

InChI

InChI=1S/C20H21BrN6O/c1-14-19(21)15(2)27(24-14)17-5-3-16(4-6-17)20(28)26-11-9-25(10-12-26)18-13-22-7-8-23-18/h3-8,13H,9-12H2,1-2H3