2,2-dimethyl-1-[(1S,3R)-3-methyl-1-oxidanylidene-3H-1,2-benzothiazol-2-yl]propan-1-one

Systemtic Name: 2,2-dimethyl-1-[(1S,3R)-3-methyl-1-oxidanylidene-3H-1,2-benzothiazol-2-yl]propan-1-one Openeye Name: 2,2-dimethyl-1-[(1S,3R)-3-methyl-1-oxo-3H-1,2-benzothiazol-2-yl]propan-1-one CAS Name: 2,2-dimethyl-1-[(1S,3R)-3-methyl-1-oxo-3H-1,2-benzothiazol-2-yl]-1-propanone IUPAC Name: 2,2-dimethyl-1-[(1S,3R)-3-methyl-1-oxo-3H-1,2-benzothiazol-2-yl]propan-1-one Traditional Name: 1-[(1S,3R)-1-keto-3-methyl-3H-1,2-benzothiazol-2-yl]-2,2-dimethyl-propan-1-one Formula: C13H17NO2S MolecularWeight: 251.34458

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC=CC=C2S(=O)N1C(=O)C(C)(C)C

Isomeric SMILES

C[C@@H]1C2=CC=CC=C2[S@](=O)N1C(=O)C(C)(C)C

InChI

InChI=1S/C13H17NO2S/c1-9-10-7-5-6-8-11(10)17(16)14(9)12(15)13(2,3)4/h5-9H,1-4H3/t9-,17+/m1/s1