(2S)-6-fluoranyl-1-(4-isothiocyanatophenyl)sulfonyl-2-methyl-3,4-dihydro-2H-quinoline

Systemtic Name: (2S)-6-fluoranyl-1-(4-isothiocyanatophenyl)sulfonyl-2-methyl-3,4-dihydro-2H-quinoline Openeye Name: (2S)-6-fluoro-1-(4-isothiocyanatophenyl)sulfonyl-2-methyl-3,4-dihydro-2H-quinoline CAS Name: (2S)-6-fluoro-1-(4-isothiocyanatophenyl)sulfonyl-2-methyl-3,4-dihydro-2H-quinoline IUPAC Name: (2S)-6-fluoro-1-(4-isothiocyanatophenyl)sulfonyl-2-methyl-3,4-dihydro-2H-quinoline Traditional Name: (2S)-6-fluoro-1-(4-isothiocyanatophenyl)sulfonyl-2-methyl-3,4-dihydro-2H-quinoline Formula: C17H15FN2O2S2 MolecularWeight: 362.441603

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(N1S(=O)(=O)C3=CC=C(C=C3)N=C=S)C=CC(=C2)F

Isomeric SMILES

C[C@H]1CCC2=C(N1S(=O)(=O)C3=CC=C(C=C3)N=C=S)C=CC(=C2)F

InChI

InChI=1S/C17H15FN2O2S2/c1-12-2-3-13-10-14(18)4-9-17(13)20(12)24(21,22)16-7-5-15(6-8-16)19-11-23/h4-10,12H,2-3H2,1H3/t12-/m0/s1