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

Systemtic Name: [4-[5-ethyl-2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]piperazin-1-yl]-naphthalen-2-yl-methanone Openeye Name: [4-[5-ethyl-2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]piperazin-1-yl]-(2-naphthyl)methanone CAS Name: [4-[5-ethyl-2-(3-fluorophenyl)-6-methyl-4-pyrimidinyl]-1-piperazinyl]-(2-naphthalenyl)methanone IUPAC Name: [4-[5-ethyl-2-(3-fluorophenyl)-6-methylpyrimidin-4-yl]piperazin-1-yl]-naphthalen-2-ylmethanone Traditional Name: [4-[5-ethyl-2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]piperazino]-(2-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=CC4=CC=CC=C4C=C3)C5=CC(=CC=C5)F)C

Isomeric SMILES

CCC1=C(N=C(N=C1N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4C=C3)C5=CC(=CC=C5)F)C

InChI

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