(11S,11aS)-11-(3-fluorophenyl)-11,11a-dihydroindeno[2,1-c][1,5]benzothiazepin-12-one

Systemtic Name: (11S,11aS)-11-(3-fluorophenyl)-11,11a-dihydroindeno[2,1-c][1,5]benzothiazepin-12-one Openeye Name: (11S,11aS)-11-(3-fluorophenyl)-11,11a-dihydroindeno[2,1-c][1,5]benzothiazepin-12-one CAS Name: (11S,11aS)-11-(3-fluorophenyl)-11,11a-dihydroindeno[2,1-c][1,5]benzothiazepin-12-one IUPAC Name: (11S,11aS)-11-(3-fluorophenyl)-11,11a-dihydroindeno[2,1-c][1,5]benzothiazepin-12-one Traditional Name: (11S,11aS)-11-(3-fluorophenyl)-11,11a-dihydroindeno[2,1-c][1,5]benzothiazepin-12-one Formula: C22H14FNOS MolecularWeight: 359.416063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=NC4=CC=CC=C4SC(C3C2=O)C5=CC(=CC=C5)F

Isomeric SMILES

C1=CC=C2C(=C1)C3=NC4=CC=CC=C4S[C@@H]([C@@H]3C2=O)C5=CC(=CC=C5)F

InChI

InChI=1S/C22H14FNOS/c23-14-7-5-6-13(12-14)22-19-20(15-8-1-2-9-16(15)21(19)25)24-17-10-3-4-11-18(17)26-22/h1-12,19,22H/t19-,22+/m0/s1