5-chloranyl-3-ethyl-9-fluoranyl-5,6-dihydrobenzo[b][1]benzothiepine

Systemtic Name: 5-chloranyl-3-ethyl-9-fluoranyl-5,6-dihydrobenzo[b][1]benzothiepine Openeye Name: 5-chloro-3-ethyl-9-fluoro-5,6-dihydrobenzo[b][1]benzothiepine CAS Name: 5-chloro-3-ethyl-9-fluoro-5,6-dihydrobenzo[b][1]benzothiepin IUPAC Name: 5-chloro-3-ethyl-9-fluoro-5,6-dihydrobenzo[b][1]benzothiepine Traditional Name: 5-chloro-3-ethyl-9-fluoro-5,6-dihydrobenzo[b][1]benzothiepin Formula: C16H14ClFS MolecularWeight: 292.798763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)SC3=C(CC2Cl)C=CC(=C3)F

Isomeric SMILES

CCC1=CC2=C(C=C1)SC3=C(CC2Cl)C=CC(=C3)F

InChI

InChI=1S/C16H14ClFS/c1-2-10-3-6-15-13(7-10)14(17)8-11-4-5-12(18)9-16(11)19-15/h3-7,9,14H,2,8H2,1H3