(E)-3-(4-butoxyphenyl)-2-cyano-N-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enamide

Systemtic Name: (E)-3-(4-butoxyphenyl)-2-cyano-N-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enamide Openeye Name: (E)-3-(4-butoxyphenyl)-2-cyano-N-[4-(4-ethoxyphenyl)thiazol-2-yl]prop-2-enamide CAS Name: (E)-3-(4-butoxyphenyl)-2-cyano-N-[4-(4-ethoxyphenyl)-2-thiazolyl]-2-propenamide IUPAC Name: (E)-3-(4-butoxyphenyl)-2-cyano-N-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enamide Traditional Name: (E)-3-(4-butoxyphenyl)-2-cyano-N-(4-p-phenetylthiazol-2-yl)acrylamide Formula: C25H25N3O3S MolecularWeight: 447.5493

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)OCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)OCC

InChI

InChI=1S/C25H25N3O3S/c1-3-5-14-31-22-10-6-18(7-11-22)15-20(16-26)24(29)28-25-27-23(17-32-25)19-8-12-21(13-9-19)30-4-2/h6-13,15,17H,3-5,14H2,1-2H3,(H,27,28,29)/b20-15+