3-(2-fluoranyl-3-methyl-phenyl)-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]prop-2-yn-1-one

Systemtic Name: 3-(2-fluoranyl-3-methyl-phenyl)-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]prop-2-yn-1-one Openeye Name: 3-(2-fluoro-3-methyl-phenyl)-1-(4-thiazol-2-ylpiperazin-1-yl)prop-2-yn-1-one CAS Name: 3-(2-fluoro-3-methylphenyl)-1-[4-(2-thiazolyl)-1-piperazinyl]-2-propyn-1-one IUPAC Name: 3-(2-fluoro-3-methylphenyl)-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]prop-2-yn-1-one Traditional Name: 3-(2-fluoro-3-methyl-phenyl)-1-(4-thiazol-2-ylpiperazino)prop-2-yn-1-one Formula: C17H16FN3OS MolecularWeight: 329.391843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1F)C#CC(=O)N2CCN(CC2)C3=NC=CS3

Isomeric SMILES

CC1=CC=CC(=C1F)C#CC(=O)N2CCN(CC2)C3=NC=CS3

InChI

InChI=1S/C17H16FN3OS/c1-13-3-2-4-14(16(13)18)5-6-15(22)20-8-10-21(11-9-20)17-19-7-12-23-17/h2-4,7,12H,8-11H2,1H3