2-[3-oxidanylidene-6-(trifluoromethyl)-4H-1,4-benzothiazin-2-yl]-N-(2-pyrrolidin-1-ylbutyl)ethanamide

Systemtic Name: 2-[3-oxidanylidene-6-(trifluoromethyl)-4H-1,4-benzothiazin-2-yl]-N-(2-pyrrolidin-1-ylbutyl)ethanamide Openeye Name: 2-[3-oxo-6-(trifluoromethyl)-4H-1,4-benzothiazin-2-yl]-N-(2-pyrrolidin-1-ylbutyl)acetamide CAS Name: 2-[3-oxo-6-(trifluoromethyl)-4H-1,4-benzothiazin-2-yl]-N-[2-(1-pyrrolidinyl)butyl]acetamide IUPAC Name: 2-[3-oxo-6-(trifluoromethyl)-4H-1,4-benzothiazin-2-yl]-N-(2-pyrrolidin-1-ylbutyl)acetamide Traditional Name: 2-[3-keto-6-(trifluoromethyl)-4H-1,4-benzothiazin-2-yl]-N-(2-pyrrolidinobutyl)acetamide Formula: C19H24F3N3O2S MolecularWeight: 415.47297

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)CC1C(=O)NC2=C(S1)C=CC(=C2)C(F)(F)F)N3CCCC3

Isomeric SMILES

CCC(CNC(=O)CC1C(=O)NC2=C(S1)C=CC(=C2)C(F)(F)F)N3CCCC3

InChI

InChI=1S/C19H24F3N3O2S/c1-2-13(25-7-3-4-8-25)11-23-17(26)10-16-18(27)24-14-9-12(19(20,21)22)5-6-15(14)28-16/h5-6,9,13,16H,2-4,7-8,10-11H2,1H3,(H,23,26)(H,24,27)