2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-1-(3-fluorophenyl)ethanone

Systemtic Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-1-(3-fluorophenyl)ethanone Openeye Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-1-(3-fluorophenyl)ethanone CAS Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-1-(3-fluorophenyl)ethanone IUPAC Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-1-(3-fluorophenyl)ethanone Traditional Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-1-(3-fluorophenyl)ethanone Formula: C16H16FN3OS MolecularWeight: 317.381143

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3CC3)SCC(=O)C4=CC(=CC=C4)F

Isomeric SMILES

C1CC1C2=NN=C(N2C3CC3)SCC(=O)C4=CC(=CC=C4)F

InChI

InChI=1S/C16H16FN3OS/c17-12-3-1-2-11(8-12)14(21)9-22-16-19-18-15(10-4-5-10)20(16)13-6-7-13/h1-3,8,10,13H,4-7,9H2