1-[4-[2-(3-fluorophenyl)-5,6-dimethyl-pyrimidin-4-yl]piperazin-1-yl]-3,3-dimethyl-butan-1-one

Systemtic Name: 1-[4-[2-(3-fluorophenyl)-5,6-dimethyl-pyrimidin-4-yl]piperazin-1-yl]-3,3-dimethyl-butan-1-one Openeye Name: 1-[4-[2-(3-fluorophenyl)-5,6-dimethyl-pyrimidin-4-yl]piperazin-1-yl]-3,3-dimethyl-butan-1-one CAS Name: 1-[4-[2-(3-fluorophenyl)-5,6-dimethyl-4-pyrimidinyl]-1-piperazinyl]-3,3-dimethyl-1-butanone IUPAC Name: 1-[4-[2-(3-fluorophenyl)-5,6-dimethylpyrimidin-4-yl]piperazin-1-yl]-3,3-dimethylbutan-1-one Traditional Name: 1-[4-[2-(3-fluorophenyl)-5,6-dimethyl-pyrimidin-4-yl]piperazino]-3,3-dimethyl-butan-1-one Formula: C22H29FN4O MolecularWeight: 384.490263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1N2CCN(CC2)C(=O)CC(C)(C)C)C3=CC(=CC=C3)F)C

Isomeric SMILES

CC1=C(N=C(N=C1N2CCN(CC2)C(=O)CC(C)(C)C)C3=CC(=CC=C3)F)C

InChI

InChI=1S/C22H29FN4O/c1-15-16(2)24-20(17-7-6-8-18(23)13-17)25-21(15)27-11-9-26(10-12-27)19(28)14-22(3,4)5/h6-8,13H,9-12,14H2,1-5H3