3-(3-fluoranyl-5-methyl-phenyl)-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]prop-2-yn-1-one

Systemtic Name: 3-(3-fluoranyl-5-methyl-phenyl)-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]prop-2-yn-1-one Openeye Name: 3-(3-fluoro-5-methyl-phenyl)-1-(4-thiazol-2-ylpiperazin-1-yl)prop-2-yn-1-one CAS Name: 3-(3-fluoro-5-methylphenyl)-1-[4-(2-thiazolyl)-1-piperazinyl]-2-propyn-1-one IUPAC Name: 3-(3-fluoro-5-methylphenyl)-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]prop-2-yn-1-one Traditional Name: 3-(3-fluoro-5-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(=C1)C#CC(=O)N2CCN(CC2)C3=NC=CS3)F

Isomeric SMILES

CC1=CC(=CC(=C1)C#CC(=O)N2CCN(CC2)C3=NC=CS3)F

InChI

InChI=1S/C17H16FN3OS/c1-13-10-14(12-15(18)11-13)2-3-16(22)20-5-7-21(8-6-20)17-19-4-9-23-17/h4,9-12H,5-8H2,1H3