2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]ethanone Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-[4-(4-fluorobenzoyl)piperazin-1-yl]ethanone CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]ethanone IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-[4-(4-fluorobenzoyl)piperazin-1-yl]ethanone Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-1-[4-(4-fluorobenzoyl)piperazino]ethanone Formula: C19H21FN4O2S MolecularWeight: 388.459043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C19H21FN4O2S/c1-13-11-14(2)22-19(21-13)27-12-17(25)23-7-9-24(10-8-23)18(26)15-3-5-16(20)6-4-15/h3-6,11H,7-10,12H2,1-2H3