(4-tert-butylphenyl)-[4-[2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]piperazin-1-yl]methanone

Systemtic Name: (4-tert-butylphenyl)-[4-[2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]piperazin-1-yl]methanone Openeye Name: (4-tert-butylphenyl)-[4-[2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]piperazin-1-yl]methanone CAS Name: (4-tert-butylphenyl)-[4-[2-(3-fluorophenyl)-6-methyl-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: (4-tert-butylphenyl)-[4-[2-(3-fluorophenyl)-6-methylpyrimidin-4-yl]piperazin-1-yl]methanone Traditional Name: (4-tert-butylphenyl)-[4-[2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]piperazino]methanone Formula: C26H29FN4O MolecularWeight: 432.533063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C2=CC(=CC=C2)F)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=CC(=NC(=N1)C2=CC(=CC=C2)F)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C26H29FN4O/c1-18-16-23(29-24(28-18)20-6-5-7-22(27)17-20)30-12-14-31(15-13-30)25(32)19-8-10-21(11-9-19)26(2,3)4/h5-11,16-17H,12-15H2,1-4H3