1-[4-(4-fluorophenyl)piperazin-1-yl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanone Openeye Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanone CAS Name: 1-[4-(4-fluorophenyl)-1-piperazinyl]-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]ethanone IUPAC Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylethanone Traditional Name: 1-[4-(4-fluorophenyl)piperazino]-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]ethanone Formula: C23H23FN4OS MolecularWeight: 422.518323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H23FN4OS/c1-17-15-21(18-5-3-2-4-6-18)26-23(25-17)30-16-22(29)28-13-11-27(12-14-28)20-9-7-19(24)8-10-20/h2-10,15H,11-14,16H2,1H3