ethyl 4-[5-[(E)-2-cyano-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]furan-2-yl]benzoate

Systemtic Name: ethyl 4-[5-[(E)-2-cyano-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]furan-2-yl]benzoate Openeye Name: ethyl 4-[5-[(E)-2-cyano-2-(4-phenylthiazol-2-yl)vinyl]-2-furyl]benzoate CAS Name: 4-[5-[(E)-2-cyano-2-(4-phenyl-2-thiazolyl)ethenyl]-2-furanyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[5-[(E)-2-cyano-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]furan-2-yl]benzoate Traditional Name: 4-[5-[(E)-2-cyano-2-(4-phenylthiazol-2-yl)vinyl]-2-furyl]benzoic acid ethyl ester Formula: C25H18N2O3S MolecularWeight: 426.48702

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C(C#N)C3=NC(=CS3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)/C=C(\C#N)/C3=NC(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C25H18N2O3S/c1-2-29-25(28)19-10-8-18(9-11-19)23-13-12-21(30-23)14-20(15-26)24-27-22(16-31-24)17-6-4-3-5-7-17/h3-14,16H,2H2,1H3/b20-14+