N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-(4-propanoylphenoxy)ethanamide

Systemtic Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-(4-propanoylphenoxy)ethanamide Openeye Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-(4-propanoylphenoxy)acetamide CAS Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-[4-(1-oxopropyl)phenoxy]acetamide IUPAC Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-(4-propanoylphenoxy)acetamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-2-(4-propionylphenoxy)acetamide Formula: C19H18N2O5S2 MolecularWeight: 418.48662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N2O5S2/c1-3-16(22)12-4-6-13(7-5-12)26-11-18(23)21-19-20-15-9-8-14(28(2,24)25)10-17(15)27-19/h4-10H,3,11H2,1-2H3,(H,20,21,23)