(E)-2-cyano-3-(3-ethoxy-4-phenylmethoxy-phenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(3-ethoxy-4-phenylmethoxy-phenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide Openeye Name: (E)-3-(4-benzyloxy-3-ethoxy-phenyl)-2-cyano-N-thiazol-2-yl-prop-2-enamide CAS Name: (E)-2-cyano-3-(3-ethoxy-4-phenylmethoxyphenyl)-N-(2-thiazolyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-(3-ethoxy-4-phenylmethoxyphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide Traditional Name: (E)-3-(4-benzoxy-3-ethoxy-phenyl)-2-cyano-N-thiazol-2-yl-acrylamide Formula: C22H19N3O3S MolecularWeight: 405.46956

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=NC=CS2)OCC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)NC2=NC=CS2)OCC3=CC=CC=C3

InChI

InChI=1S/C22H19N3O3S/c1-2-27-20-13-17(8-9-19(20)28-15-16-6-4-3-5-7-16)12-18(14-23)21(26)25-22-24-10-11-29-22/h3-13H,2,15H2,1H3,(H,24,25,26)/b18-12+