7-[4-(trifluoromethyl)phenyl]-1,5-dihydro-4,1-benzothiazepin-2-one

Systemtic Name: 7-[4-(trifluoromethyl)phenyl]-1,5-dihydro-4,1-benzothiazepin-2-one Openeye Name: 7-[4-(trifluoromethyl)phenyl]-1,5-dihydro-4,1-benzothiazepin-2-one CAS Name: 7-[4-(trifluoromethyl)phenyl]-1,5-dihydro-4,1-benzothiazepin-2-one IUPAC Name: 7-[4-(trifluoromethyl)phenyl]-1,5-dihydro-4,1-benzothiazepin-2-one Traditional Name: 7-[4-(trifluoromethyl)phenyl]-1,5-dihydro-4,1-benzothiazepin-2-one Formula: C16H12F3NOS MolecularWeight: 323.33279

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)C3=CC=C(C=C3)C(F)(F)F)NC(=O)CS1

Isomeric SMILES

C1C2=C(C=CC(=C2)C3=CC=C(C=C3)C(F)(F)F)NC(=O)CS1

InChI

InChI=1S/C16H12F3NOS/c17-16(18,19)13-4-1-10(2-5-13)11-3-6-14-12(7-11)8-22-9-15(21)20-14/h1-7H,8-9H2,(H,20,21)