(E)-3-(2-bromanyl-4,5-diethoxy-phenyl)-2-cyano-N-(4-phenyl-1,3-thiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-3-(2-bromanyl-4,5-diethoxy-phenyl)-2-cyano-N-(4-phenyl-1,3-thiazol-2-yl)prop-2-enamide Openeye Name: (E)-3-(2-bromo-4,5-diethoxy-phenyl)-2-cyano-N-(4-phenylthiazol-2-yl)prop-2-enamide CAS Name: (E)-3-(2-bromo-4,5-diethoxyphenyl)-2-cyano-N-(4-phenyl-2-thiazolyl)-2-propenamide IUPAC Name: (E)-3-(2-bromo-4,5-diethoxyphenyl)-2-cyano-N-(4-phenyl-1,3-thiazol-2-yl)prop-2-enamide Traditional Name: (E)-3-(2-bromo-4,5-diethoxy-phenyl)-2-cyano-N-(4-phenylthiazol-2-yl)acrylamide Formula: C23H20BrN3O3S MolecularWeight: 498.3922

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20BrN3O3S/c1-3-29-20-11-16(18(24)12-21(20)30-4-2)10-17(13-25)22(28)27-23-26-19(14-31-23)15-8-6-5-7-9-15/h5-12,14H,3-4H2,1-2H3,(H,26,27,28)/b17-10+