4-ethanoyl-N-[(4S)-8-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]-1H-pyrrole-2-carboxamide

Systemtic Name: 4-ethanoyl-N-[(4S)-8-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]-1H-pyrrole-2-carboxamide Openeye Name: 4-acetyl-N-[(4S)-8-fluorothiochroman-4-yl]-1H-pyrrole-2-carboxamide CAS Name: 4-acetyl-N-[(4S)-8-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-acetyl-N-[(4S)-8-fluoro-3,4-dihydro-2H-thiochromen-4-yl]-1H-pyrrole-2-carboxamide Traditional Name: 4-acetyl-N-[(4S)-8-fluorothiochroman-4-yl]-1H-pyrrole-2-carboxamide Formula: C16H15FN2O2S MolecularWeight: 318.365903

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CNC(=C1)C(=O)NC2CCSC3=C2C=CC=C3F

Isomeric SMILES

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

InChI

InChI=1S/C16H15FN2O2S/c1-9(20)10-7-14(18-8-10)16(21)19-13-5-6-22-15-11(13)3-2-4-12(15)17/h2-4,7-8,13,18H,5-6H2,1H3,(H,19,21)/t13-/m0/s1