5-ethyl-9-(trifluoromethyl)benzo[b][1,4]benzothiazepin-6-one

Systemtic Name: 5-ethyl-9-(trifluoromethyl)benzo[b][1,4]benzothiazepin-6-one Openeye Name: 5-ethyl-9-(trifluoromethyl)benzo[b][1,4]benzothiazepin-6-one CAS Name: 5-ethyl-9-(trifluoromethyl)-6-benzo[b][1,4]benzothiazepinone IUPAC Name: 5-ethyl-9-(trifluoromethyl)benzo[b][1,4]benzothiazepin-6-one Traditional Name: 5-ethyl-9-(trifluoromethyl)benzo[b][1,4]benzothiazepin-6-one Formula: C16H12F3NOS MolecularWeight: 323.33279

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2SC3=C(C1=O)C=CC(=C3)C(F)(F)F

Isomeric SMILES

CCN1C2=CC=CC=C2SC3=C(C1=O)C=CC(=C3)C(F)(F)F

InChI

InChI=1S/C16H12F3NOS/c1-2-20-12-5-3-4-6-13(12)22-14-9-10(16(17,18)19)7-8-11(14)15(20)21/h3-9H,2H2,1H3