3-(4-butoxy-3-ethoxy-phenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3-(4-butoxy-3-ethoxy-phenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-(4-butoxy-3-ethoxy-phenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-(4-butoxy-3-ethoxyphenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(4-butoxy-3-ethoxyphenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-(4-butoxy-3-ethoxy-phenyl)-N-(6-mesyl-1,3-benzothiazol-2-yl)propionamide Formula: C23H28N2O5S2 MolecularWeight: 476.60882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CCC(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CCC(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C)OCC

InChI

InChI=1S/C23H28N2O5S2/c1-4-6-13-30-19-11-7-16(14-20(19)29-5-2)8-12-22(26)25-23-24-18-10-9-17(32(3,27)28)15-21(18)31-23/h7,9-11,14-15H,4-6,8,12-13H2,1-3H3,(H,24,25,26)