[4-[5-ethyl-2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]piperazin-1-yl]-naphthalen-1-yl-methanone

Systemtic Name: [4-[5-ethyl-2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]piperazin-1-yl]-naphthalen-1-yl-methanone Openeye Name: [4-[5-ethyl-2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]piperazin-1-yl]-(1-naphthyl)methanone CAS Name: [4-[5-ethyl-2-(3-fluorophenyl)-6-methyl-4-pyrimidinyl]-1-piperazinyl]-(1-naphthalenyl)methanone IUPAC Name: [4-[5-ethyl-2-(3-fluorophenyl)-6-methylpyrimidin-4-yl]piperazin-1-yl]-naphthalen-1-ylmethanone Traditional Name: [4-[5-ethyl-2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]piperazino]-(1-naphthyl)methanone Formula: C28H27FN4O MolecularWeight: 454.538583

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(N=C1N2CCN(CC2)C(=O)C3=CC=CC4=CC=CC=C43)C5=CC(=CC=C5)F)C

Isomeric SMILES

CCC1=C(N=C(N=C1N2CCN(CC2)C(=O)C3=CC=CC4=CC=CC=C43)C5=CC(=CC=C5)F)C

InChI

InChI=1S/C28H27FN4O/c1-3-23-19(2)30-26(21-10-6-11-22(29)18-21)31-27(23)32-14-16-33(17-15-32)28(34)25-13-7-9-20-8-4-5-12-24(20)25/h4-13,18H,3,14-17H2,1-2H3