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

Systemtic Name: ethyl 4-[5-[(E)-2-(5-acetamido-4-phenyl-1,3-thiazol-2-yl)-2-cyano-ethenyl]furan-2-yl]benzoate Openeye Name: ethyl 4-[5-[(E)-2-(5-acetamido-4-phenyl-thiazol-2-yl)-2-cyano-vinyl]-2-furyl]benzoate CAS Name: 4-[5-[(E)-2-(5-acetamido-4-phenyl-2-thiazolyl)-2-cyanoethenyl]-2-furanyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[5-[(E)-2-(5-acetamido-4-phenyl-1,3-thiazol-2-yl)-2-cyanoethenyl]furan-2-yl]benzoate Traditional Name: 4-[5-[(E)-2-(5-acetamido-4-phenyl-thiazol-2-yl)-2-cyano-vinyl]-2-furyl]benzoic acid ethyl ester Formula: C27H21N3O4S MolecularWeight: 483.53834

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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(=C(S3)NC(=O)C)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)/C=C(\C#N)/C3=NC(=C(S3)NC(=O)C)C4=CC=CC=C4

InChI

InChI=1S/C27H21N3O4S/c1-3-33-27(32)20-11-9-18(10-12-20)23-14-13-22(34-23)15-21(16-28)25-30-24(19-7-5-4-6-8-19)26(35-25)29-17(2)31/h4-15H,3H2,1-2H3,(H,29,31)/b21-15+