(2S)-2-acetamido-3-methyl-N-[6-(trifluoromethyloxy)-1,3-benzothiazol-2-yl]butanamide

Systemtic Name: (2S)-2-acetamido-3-methyl-N-[6-(trifluoromethyloxy)-1,3-benzothiazol-2-yl]butanamide Openeye Name: (2S)-2-acetamido-3-methyl-N-[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]butanamide CAS Name: (2S)-2-acetamido-3-methyl-N-[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]butanamide IUPAC Name: (2S)-2-acetamido-3-methyl-N-[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]butanamide Traditional Name: (2S)-2-acetamido-3-methyl-N-[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]butyramide Formula: C15H16F3N3O3S MolecularWeight: 375.36605

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=NC2=C(S1)C=C(C=C2)OC(F)(F)F)NC(=O)C

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=NC2=C(S1)C=C(C=C2)OC(F)(F)F)NC(=O)C

InChI

InChI=1S/C15H16F3N3O3S/c1-7(2)12(19-8(3)22)13(23)21-14-20-10-5-4-9(6-11(10)25-14)24-15(16,17)18/h4-7,12H,1-3H3,(H,19,22)(H,20,21,23)/t12-/m0/s1