3-azanyl-9-fluoranyl-5,6-dihydrobenzo[b][1]benzothiepin-5-ol

Systemtic Name: 3-azanyl-9-fluoranyl-5,6-dihydrobenzo[b][1]benzothiepin-5-ol Openeye Name: 3-amino-9-fluoro-5,6-dihydrobenzo[b][1]benzothiepin-5-ol CAS Name: 3-amino-9-fluoro-5,6-dihydrobenzo[b][1]benzothiepin-5-ol IUPAC Name: 3-amino-9-fluoro-5,6-dihydrobenzo[b][1]benzothiepin-5-ol Traditional Name: 3-amino-9-fluoro-5,6-dihydrobenzo[b][1]benzothiepin-5-ol Formula: C14H12FNOS MolecularWeight: 261.314583

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(C=CC(=C2)N)SC3=C1C=CC(=C3)F)O

Isomeric SMILES

C1C(C2=C(C=CC(=C2)N)SC3=C1C=CC(=C3)F)O

InChI

InChI=1S/C14H12FNOS/c15-9-2-1-8-5-12(17)11-7-10(16)3-4-13(11)18-14(8)6-9/h1-4,6-7,12,17H,5,16H2