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

Systemtic Name: (E)-3-(4-butoxyphenyl)-2-cyano-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)prop-2-enamide Openeye Name: (E)-3-(4-butoxyphenyl)-2-cyano-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)prop-2-enamide CAS Name: (E)-3-(4-butoxyphenyl)-2-cyano-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-2-propenamide IUPAC Name: (E)-3-(4-butoxyphenyl)-2-cyano-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)prop-2-enamide Traditional Name: (E)-3-(4-butoxyphenyl)-2-cyano-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)acrylamide Formula: C22H26N4O2S MolecularWeight: 410.53244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NN=C(S2)C3CCCCC3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=NN=C(S2)C3CCCCC3

InChI

InChI=1S/C22H26N4O2S/c1-2-3-13-28-19-11-9-16(10-12-19)14-18(15-23)20(27)24-22-26-25-21(29-22)17-7-5-4-6-8-17/h9-12,14,17H,2-8,13H2,1H3,(H,24,26,27)/b18-14+