2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-1-(5-fluoranyl-2-methoxy-phenyl)ethanone

Systemtic Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-1-(5-fluoranyl-2-methoxy-phenyl)ethanone Openeye Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-1-(5-fluoro-2-methoxy-phenyl)ethanone CAS Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-1-(5-fluoro-2-methoxyphenyl)ethanone IUPAC Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-1-(5-fluoro-2-methoxyphenyl)ethanone Traditional Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-1-(5-fluoro-2-methoxy-phenyl)ethanone Formula: C16H18FN3O2S MolecularWeight: 335.396423

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)C2=C(C=CC(=C2)F)OC)C3CC3

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)C2=C(C=CC(=C2)F)OC)C3CC3

InChI

InChI=1S/C16H18FN3O2S/c1-3-20-15(10-4-5-10)18-19-16(20)23-9-13(21)12-8-11(17)6-7-14(12)22-2/h6-8,10H,3-5,9H2,1-2H3