1-(6-fluoranyl-2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-(6-fluoranyl-2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(6-fluoro-2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-[[4-methyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-(6-fluoro-2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-(6-fluoro-2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(6-fluoro-2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-[[4-methyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]ethanone Formula: C20H20FN5OS MolecularWeight: 397.469103

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(N1C(=O)CSC3=NN=C(N3C)C4=CC=NC=C4)C=CC(=C2)F

Isomeric SMILES

CC1CCC2=C(N1C(=O)CSC3=NN=C(N3C)C4=CC=NC=C4)C=CC(=C2)F

InChI

InChI=1S/C20H20FN5OS/c1-13-3-4-15-11-16(21)5-6-17(15)26(13)18(27)12-28-20-24-23-19(25(20)2)14-7-9-22-10-8-14/h5-11,13H,3-4,12H2,1-2H3