(2S)-N-[(4S)-6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]-2-phenoxy-propanamide

Systemtic Name: (2S)-N-[(4S)-6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]-2-phenoxy-propanamide Openeye Name: (2S)-N-[(4S)-6-fluorothiochroman-4-yl]-2-phenoxy-propanamide CAS Name: (2S)-N-[(4S)-6-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl]-2-phenoxypropanamide IUPAC Name: (2S)-N-[(4S)-6-fluoro-3,4-dihydro-2H-thiochromen-4-yl]-2-phenoxypropanamide Traditional Name: (2S)-N-[(4S)-6-fluorothiochroman-4-yl]-2-phenoxy-propionamide Formula: C18H18FNO2S MolecularWeight: 331.404423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCSC2=C1C=C(C=C2)F)OC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)N[C@H]1CCSC2=C1C=C(C=C2)F)OC3=CC=CC=C3

InChI

InChI=1S/C18H18FNO2S/c1-12(22-14-5-3-2-4-6-14)18(21)20-16-9-10-23-17-8-7-13(19)11-15(16)17/h2-8,11-12,16H,9-10H2,1H3,(H,20,21)/t12-,16-/m0/s1