2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[2-morpholino-5-(trifluoromethyl)phenyl]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylmethylthio)-N-[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylmethylthio)-N-[2-morpholino-5-(trifluoromethyl)phenyl]acetamide Formula: C21H20F3N3O2S2 MolecularWeight: 467.52761

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(F)(F)F)NC(=O)CSCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(F)(F)F)NC(=O)CSCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H20F3N3O2S2/c22-21(23,24)14-5-6-17(27-7-9-29-10-8-27)16(11-14)25-19(28)12-30-13-20-26-15-3-1-2-4-18(15)31-20/h1-6,11H,7-10,12-13H2,(H,25,28)