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

Systemtic Name: ethyl 3-[5-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyano-ethenyl]furan-2-yl]benzoate Openeye Name: ethyl 3-[5-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyano-vinyl]-2-furyl]benzoate CAS Name: 3-[5-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]-2-furanyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-[5-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]furan-2-yl]benzoate Traditional Name: 3-[5-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyano-vinyl]-2-furyl]benzoic acid ethyl ester Formula: C23H16N2O3S MolecularWeight: 400.44974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC(=C1)C2=CC=C(O2)C=C(C#N)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC(=O)C1=CC=CC(=C1)C2=CC=C(O2)/C=C(\C#N)/C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H16N2O3S/c1-2-27-23(26)16-7-5-6-15(12-16)20-11-10-18(28-20)13-17(14-24)22-25-19-8-3-4-9-21(19)29-22/h3-13H,2H2,1H3/b17-13+