(E)-N-(1,3-benzothiazol-2-yl)-3-(4-butoxyphenyl)-2-cyano-prop-2-enamide

Systemtic Name: (E)-N-(1,3-benzothiazol-2-yl)-3-(4-butoxyphenyl)-2-cyano-prop-2-enamide Openeye Name: (E)-N-(1,3-benzothiazol-2-yl)-3-(4-butoxyphenyl)-2-cyano-prop-2-enamide CAS Name: (E)-N-(1,3-benzothiazol-2-yl)-3-(4-butoxyphenyl)-2-cyano-2-propenamide IUPAC Name: (E)-N-(1,3-benzothiazol-2-yl)-3-(4-butoxyphenyl)-2-cyanoprop-2-enamide Traditional Name: (E)-N-(1,3-benzothiazol-2-yl)-3-(4-butoxyphenyl)-2-cyano-acrylamide Formula: C21H19N3O2S MolecularWeight: 377.45946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C21H19N3O2S/c1-2-3-12-26-17-10-8-15(9-11-17)13-16(14-22)20(25)24-21-23-18-6-4-5-7-19(18)27-21/h4-11,13H,2-3,12H2,1H3,(H,23,24,25)/b16-13+