N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-(2,3,6-trimethylphenoxy)ethanamide

Systemtic Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-(2,3,6-trimethylphenoxy)ethanamide Openeye Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-(2,3,6-trimethylphenoxy)acetamide CAS Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-(2,3,6-trimethylphenoxy)acetamide IUPAC Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-(2,3,6-trimethylphenoxy)acetamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-2-(2,3,6-trimethylphenoxy)acetamide Formula: C19H20N2O4S2 MolecularWeight: 404.5031

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OCC(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OCC(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C)C

InChI

InChI=1S/C19H20N2O4S2/c1-11-5-6-12(2)18(13(11)3)25-10-17(22)21-19-20-15-8-7-14(27(4,23)24)9-16(15)26-19/h5-9H,10H2,1-4H3,(H,20,21,22)