(2S)-N-[(4S)-8-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]-2-(3-methylphenoxy)propanamide

Systemtic Name: (2S)-N-[(4S)-8-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]-2-(3-methylphenoxy)propanamide Openeye Name: (2S)-N-[(4S)-8-fluorothiochroman-4-yl]-2-(3-methylphenoxy)propanamide CAS Name: (2S)-N-[(4S)-8-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl]-2-(3-methylphenoxy)propanamide IUPAC Name: (2S)-N-[(4S)-8-fluoro-3,4-dihydro-2H-thiochromen-4-yl]-2-(3-methylphenoxy)propanamide Traditional Name: (2S)-N-[(4S)-8-fluorothiochroman-4-yl]-2-(3-methylphenoxy)propionamide Formula: C19H20FNO2S MolecularWeight: 345.431003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC(C)C(=O)NC2CCSC3=C2C=CC=C3F

Isomeric SMILES

CC1=CC(=CC=C1)O[C@@H](C)C(=O)N[C@H]2CCSC3=C2C=CC=C3F

InChI

InChI=1S/C19H20FNO2S/c1-12-5-3-6-14(11-12)23-13(2)19(22)21-17-9-10-24-18-15(17)7-4-8-16(18)20/h3-8,11,13,17H,9-10H2,1-2H3,(H,21,22)/t13-,17-/m0/s1