3-(1,3-benzothiazol-2-ylsulfanyl)-N-[2-(trifluoromethyl)phenyl]propanamide

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-[2-(trifluoromethyl)phenyl]propanamide Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-[2-(trifluoromethyl)phenyl]propanamide CAS Name: 3-(1,3-benzothiazol-2-ylthio)-N-[2-(trifluoromethyl)phenyl]propanamide IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-[2-(trifluoromethyl)phenyl]propanamide Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-N-[2-(trifluoromethyl)phenyl]propionamide Formula: C17H13F3N2OS2 MolecularWeight: 382.42313

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(F)(F)F)NC(=O)CCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

C1=CC=C(C(=C1)C(F)(F)F)NC(=O)CCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H13F3N2OS2/c18-17(19,20)11-5-1-2-6-12(11)21-15(23)9-10-24-16-22-13-7-3-4-8-14(13)25-16/h1-8H,9-10H2,(H,21,23)