2-[4-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyano-ethenyl]-2,6-dimethoxy-phenoxy]ethanamide

Systemtic Name: 2-[4-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyano-ethenyl]-2,6-dimethoxy-phenoxy]ethanamide Openeye Name: 2-[4-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyano-vinyl]-2,6-dimethoxy-phenoxy]acetamide CAS Name: 2-[4-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]-2,6-dimethoxyphenoxy]acetamide IUPAC Name: 2-[4-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]-2,6-dimethoxyphenoxy]acetamide Traditional Name: 2-[4-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyano-vinyl]-2,6-dimethoxy-phenoxy]acetamide Formula: C20H17N3O4S MolecularWeight: 395.43168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OCC(=O)N)OC)C=C(C#N)C2=NC3=CC=CC=C3S2

Isomeric SMILES

COC1=CC(=CC(=C1OCC(=O)N)OC)/C=C(\C#N)/C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C20H17N3O4S/c1-25-15-8-12(9-16(26-2)19(15)27-11-18(22)24)7-13(10-21)20-23-14-5-3-4-6-17(14)28-20/h3-9H,11H2,1-2H3,(H2,22,24)/b13-7+