2-(1,3-benzoxazol-2-ylsulfanyl)-N-[4-chloranyl-2-(trifluoromethyl)phenyl]propanamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[4-chloranyl-2-(trifluoromethyl)phenyl]propanamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[4-chloro-2-(trifluoromethyl)phenyl]propanamide CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N-[4-chloro-2-(trifluoromethyl)phenyl]propanamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[4-chloro-2-(trifluoromethyl)phenyl]propanamide Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-N-[4-chloro-2-(trifluoromethyl)phenyl]propionamide Formula: C17H12ClF3N2O2S MolecularWeight: 400.80259

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)Cl)C(F)(F)F)SC2=NC3=CC=CC=C3O2

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)Cl)C(F)(F)F)SC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C17H12ClF3N2O2S/c1-9(26-16-23-13-4-2-3-5-14(13)25-16)15(24)22-12-7-6-10(18)8-11(12)17(19,20)21/h2-9H,1H3,(H,22,24)