2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl-methylamino]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl-methylamino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C23H29N7O MolecularWeight: 419.52266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CN(C)CC(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CN(C)CC(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C23H29N7O/c1-18-21(19(2)30(26-18)20-8-5-4-6-9-20)16-27(3)17-22(31)28-12-14-29(15-13-28)23-24-10-7-11-25-23/h4-11H,12-17H2,1-3H3