5-(dimethylaminomethyl)-3-oxidanyl-2-[4-(trifluoromethyl)phenyl]-2,3-dihydro-1,5-benzothiazepin-4-one

Systemtic Name: 5-(dimethylaminomethyl)-3-oxidanyl-2-[4-(trifluoromethyl)phenyl]-2,3-dihydro-1,5-benzothiazepin-4-one Openeye Name: 5-(dimethylaminomethyl)-3-hydroxy-2-[4-(trifluoromethyl)phenyl]-2,3-dihydro-1,5-benzothiazepin-4-one CAS Name: 5-(dimethylaminomethyl)-3-hydroxy-2-[4-(trifluoromethyl)phenyl]-2,3-dihydro-1,5-benzothiazepin-4-one IUPAC Name: 5-(dimethylaminomethyl)-3-hydroxy-2-[4-(trifluoromethyl)phenyl]-2,3-dihydro-1,5-benzothiazepin-4-one Traditional Name: 5-(dimethylaminomethyl)-3-hydroxy-2-[4-(trifluoromethyl)phenyl]-2,3-dihydro-1,5-benzothiazepin-4-one Formula: C19H19F3N2O2S MolecularWeight: 396.42657

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CN1C2=CC=CC=C2SC(C(C1=O)O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CN(C)CN1C2=CC=CC=C2SC(C(C1=O)O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C19H19F3N2O2S/c1-23(2)11-24-14-5-3-4-6-15(14)27-17(16(25)18(24)26)12-7-9-13(10-8-12)19(20,21)22/h3-10,16-17,25H,11H2,1-2H3