(E)-2-cyano-N-(6-methyl-1,3-benzothiazol-2-yl)-3-(2-propoxyphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(6-methyl-1,3-benzothiazol-2-yl)-3-(2-propoxyphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(6-methyl-1,3-benzothiazol-2-yl)-3-(2-propoxyphenyl)prop-2-enamide CAS Name: (E)-2-cyano-N-(6-methyl-1,3-benzothiazol-2-yl)-3-(2-propoxyphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(6-methyl-1,3-benzothiazol-2-yl)-3-(2-propoxyphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(6-methyl-1,3-benzothiazol-2-yl)-3-(2-propoxyphenyl)acrylamide Formula: C21H19N3O2S MolecularWeight: 377.45946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C=C(C#N)C(=O)NC2=NC3=C(S2)C=C(C=C3)C

Isomeric SMILES

CCCOC1=CC=CC=C1/C=C(\C#N)/C(=O)NC2=NC3=C(S2)C=C(C=C3)C

InChI

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