3-[4-(3-chlorophenyl)piperazin-1-yl]-1-(3,5-dimethyl-1-pyrimidin-2-yl-pyrazol-4-yl)propan-1-one

Systemtic Name: 3-[4-(3-chlorophenyl)piperazin-1-yl]-1-(3,5-dimethyl-1-pyrimidin-2-yl-pyrazol-4-yl)propan-1-one Openeye Name: 3-[4-(3-chlorophenyl)piperazin-1-yl]-1-(3,5-dimethyl-1-pyrimidin-2-yl-pyrazol-4-yl)propan-1-one CAS Name: 3-[4-(3-chlorophenyl)-1-piperazinyl]-1-[3,5-dimethyl-1-(2-pyrimidinyl)-4-pyrazolyl]-1-propanone IUPAC Name: 3-[4-(3-chlorophenyl)piperazin-1-yl]-1-(3,5-dimethyl-1-pyrimidin-2-ylpyrazol-4-yl)propan-1-one Traditional Name: 3-[4-(3-chlorophenyl)piperazino]-1-[3,5-dimethyl-1-(2-pyrimidyl)pyrazol-4-yl]propan-1-one Formula: C22H25ClN6O MolecularWeight: 424.9265

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=NC=CC=N2)C)C(=O)CCN3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=C(C(=NN1C2=NC=CC=N2)C)C(=O)CCN3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H25ClN6O/c1-16-21(17(2)29(26-16)22-24-8-4-9-25-22)20(30)7-10-27-11-13-28(14-12-27)19-6-3-5-18(23)15-19/h3-6,8-9,15H,7,10-14H2,1-2H3