(E)-N-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-2-cyano-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enamide

Systemtic Name: (E)-N-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-2-cyano-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enamide Openeye Name: (E)-N-[4-(3-bromophenyl)thiazol-2-yl]-2-cyano-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enamide CAS Name: (E)-N-[4-(3-bromophenyl)-2-thiazolyl]-2-cyano-3-(4-hexoxy-3-methoxyphenyl)-2-propenamide IUPAC Name: (E)-N-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-2-cyano-3-(4-hexoxy-3-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-[4-(3-bromophenyl)thiazol-2-yl]-2-cyano-3-(4-hexoxy-3-methoxy-phenyl)acrylamide Formula: C26H26BrN3O3S MolecularWeight: 540.47194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=NC(=CS2)C3=CC(=CC=C3)Br)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NC2=NC(=CS2)C3=CC(=CC=C3)Br)OC

InChI

InChI=1S/C26H26BrN3O3S/c1-3-4-5-6-12-33-23-11-10-18(14-24(23)32-2)13-20(16-28)25(31)30-26-29-22(17-34-26)19-8-7-9-21(27)15-19/h7-11,13-15,17H,3-6,12H2,1-2H3,(H,29,30,31)/b20-13+