[4-[2-(1,3-benzothiazol-2-yl)-2-cyano-ethenyl]-2-methoxy-phenyl] furan-2-carboxylate

Systemtic Name: [4-[2-(1,3-benzothiazol-2-yl)-2-cyano-ethenyl]-2-methoxy-phenyl] furan-2-carboxylate Openeye Name: [4-[2-(1,3-benzothiazol-2-yl)-2-cyano-vinyl]-2-methoxy-phenyl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [4-[2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]-2-methoxyphenyl] ester IUPAC Name: [4-[2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]-2-methoxyphenyl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [4-[2-(1,3-benzothiazol-2-yl)-2-cyano-vinyl]-2-methoxy-phenyl] ester Formula: C22H14N2O4S MolecularWeight: 402.42256

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C2=NC3=CC=CC=C3S2)OC(=O)C4=CC=CO4

Isomeric SMILES

COC1=C(C=CC(=C1)C=C(C#N)C2=NC3=CC=CC=C3S2)OC(=O)C4=CC=CO4

InChI

InChI=1S/C22H14N2O4S/c1-26-19-12-14(8-9-17(19)28-22(25)18-6-4-10-27-18)11-15(13-23)21-24-16-5-2-3-7-20(16)29-21/h2-12H,1H3