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

Systemtic Name: methyl 5-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyano-ethenyl]furan-2-carboxylate Openeye Name: methyl 5-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyano-vinyl]furan-2-carboxylate CAS Name: 5-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]furan-2-carboxylate Traditional Name: 5-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyano-vinyl]furan-2-carboxylic acid methyl ester Formula: C16H10N2O3S MolecularWeight: 310.3272

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)C=C(C#N)C2=NC3=CC=CC=C3S2

Isomeric SMILES

COC(=O)C1=CC=C(O1)/C=C(\C#N)/C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H10N2O3S/c1-20-16(19)13-7-6-11(21-13)8-10(9-17)15-18-12-4-2-3-5-14(12)22-15/h2-8H,1H3/b10-8+