1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-[4-(trifluoromethyl)phenyl]ethanone

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-[4-(trifluoromethyl)phenyl]ethanone Openeye Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-[4-(trifluoromethyl)phenyl]ethanone CAS Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-[4-(trifluoromethyl)phenyl]ethanone IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-[4-(trifluoromethyl)phenyl]ethanone Traditional Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-[4-(trifluoromethyl)phenyl]ethanone Formula: C18H16F3NOS MolecularWeight: 351.38595

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)C(=O)CC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)C(=O)CC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C18H16F3NOS/c19-18(20,21)14-8-6-13(7-9-14)12-17(23)22-10-3-11-24-16-5-2-1-4-15(16)22/h1-2,4-9H,3,10-12H2