3-chloranyl-1-[4-[5-ethyl-2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]piperazin-1-yl]-2,2-dimethyl-propan-1-one

Systemtic Name: 3-chloranyl-1-[4-[5-ethyl-2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]piperazin-1-yl]-2,2-dimethyl-propan-1-one Openeye Name: 3-chloro-1-[4-[5-ethyl-2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]piperazin-1-yl]-2,2-dimethyl-propan-1-one CAS Name: 3-chloro-1-[4-[5-ethyl-2-(3-fluorophenyl)-6-methyl-4-pyrimidinyl]-1-piperazinyl]-2,2-dimethyl-1-propanone IUPAC Name: 3-chloro-1-[4-[5-ethyl-2-(3-fluorophenyl)-6-methylpyrimidin-4-yl]piperazin-1-yl]-2,2-dimethylpropan-1-one Traditional Name: 3-chloro-1-[4-[5-ethyl-2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]piperazino]-2,2-dimethyl-propan-1-one Formula: C22H28ClFN4O MolecularWeight: 418.935323

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(N=C1N2CCN(CC2)C(=O)C(C)(C)CCl)C3=CC(=CC=C3)F)C

Isomeric SMILES

CCC1=C(N=C(N=C1N2CCN(CC2)C(=O)C(C)(C)CCl)C3=CC(=CC=C3)F)C

InChI

InChI=1S/C22H28ClFN4O/c1-5-18-15(2)25-19(16-7-6-8-17(24)13-16)26-20(18)27-9-11-28(12-10-27)21(29)22(3,4)14-23/h6-8,13H,5,9-12,14H2,1-4H3