N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-2-[(4-fluorophenyl)sulfonyl-methyl-amino]ethanamide

Systemtic Name: N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-2-[(4-fluorophenyl)sulfonyl-methyl-amino]ethanamide Openeye Name: 2-[(4-fluorophenyl)sulfonyl-methyl-amino]-N-[(4S)-thiochroman-4-yl]acetamide CAS Name: N-[(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]-2-[(4-fluorophenyl)sulfonyl-methylamino]acetamide IUPAC Name: N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-2-[(4-fluorophenyl)sulfonyl-methylamino]acetamide Traditional Name: 2-[(4-fluorophenyl)sulfonyl-methyl-amino]-N-[(4S)-thiochroman-4-yl]acetamide Formula: C18H19FN2O3S2 MolecularWeight: 394.483463

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1CCSC2=CC=CC=C12)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CN(CC(=O)N[C@H]1CCSC2=CC=CC=C12)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H19FN2O3S2/c1-21(26(23,24)14-8-6-13(19)7-9-14)12-18(22)20-16-10-11-25-17-5-3-2-4-15(16)17/h2-9,16H,10-12H2,1H3,(H,20,22)/t16-/m0/s1