3-bromanyl-N-[(4S)-6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]-4-methoxy-benzamide

Systemtic Name: 3-bromanyl-N-[(4S)-6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]-4-methoxy-benzamide Openeye Name: 3-bromo-N-[(4S)-6-fluorothiochroman-4-yl]-4-methoxy-benzamide CAS Name: 3-bromo-N-[(4S)-6-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl]-4-methoxybenzamide IUPAC Name: 3-bromo-N-[(4S)-6-fluoro-3,4-dihydro-2H-thiochromen-4-yl]-4-methoxybenzamide Traditional Name: 3-bromo-N-[(4S)-6-fluorothiochroman-4-yl]-4-methoxy-benzamide Formula: C17H15BrFNO2S MolecularWeight: 396.273903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2CCSC3=C2C=C(C=C3)F)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N[C@H]2CCSC3=C2C=C(C=C3)F)Br

InChI

InChI=1S/C17H15BrFNO2S/c1-22-15-4-2-10(8-13(15)18)17(21)20-14-6-7-23-16-5-3-11(19)9-12(14)16/h2-5,8-9,14H,6-7H2,1H3,(H,20,21)/t14-/m0/s1