1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[5-(4-fluorophenyl)-1-methyl-imidazol-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[5-(4-fluorophenyl)-1-methyl-imidazol-2-yl]sulfanyl-ethanone Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[5-(4-fluorophenyl)-1-methyl-imidazol-2-yl]sulfanyl-ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[5-(4-fluorophenyl)-1-methyl-2-imidazolyl]thio]ethanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[5-(4-fluorophenyl)-1-methylimidazol-2-yl]sulfanylethanone Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[5-(4-fluorophenyl)-1-methyl-imidazol-2-yl]thio]ethanone Formula: C21H20FN3OS MolecularWeight: 381.466403

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1SCC(=O)N2CCC3=CC=CC=C3C2)C4=CC=C(C=C4)F

Isomeric SMILES

CN1C(=CN=C1SCC(=O)N2CCC3=CC=CC=C3C2)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H20FN3OS/c1-24-19(16-6-8-18(22)9-7-16)12-23-21(24)27-14-20(26)25-11-10-15-4-2-3-5-17(15)13-25/h2-9,12H,10-11,13-14H2,1H3