N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide

Systemtic Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Openeye Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide IUPAC Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Traditional Name: N-[2-[(2-fluorobenzyl)thio]ethyl]-1-mesyl-3,4-dihydro-2H-quinoline-6-carboxamide Formula: C20H23FN2O3S2 MolecularWeight: 422.536623

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)NCCSCC3=CC=CC=C3F

Isomeric SMILES

CS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)NCCSCC3=CC=CC=C3F

InChI

InChI=1S/C20H23FN2O3S2/c1-28(25,26)23-11-4-6-15-13-16(8-9-19(15)23)20(24)22-10-12-27-14-17-5-2-3-7-18(17)21/h2-3,5,7-9,13H,4,6,10-12,14H2,1H3,(H,22,24)