(E)-2-cyano-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-(4-propoxyphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-(4-propoxyphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-(4-propoxyphenyl)prop-2-enamide CAS Name: (E)-2-cyano-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-(4-propoxyphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-(4-propoxyphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-(4-propoxyphenyl)acrylamide Formula: C21H24N4O2S MolecularWeight: 396.50586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NN=C(S2)C3CCCCC3

Isomeric SMILES

CCCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=NN=C(S2)C3CCCCC3

InChI

InChI=1S/C21H24N4O2S/c1-2-12-27-18-10-8-15(9-11-18)13-17(14-22)19(26)23-21-25-24-20(28-21)16-6-4-3-5-7-16/h8-11,13,16H,2-7,12H2,1H3,(H,23,25,26)/b17-13+