ethyl (4E)-4-[(1,3-benzothiazol-2-ylamino)methylidene]-2-methyl-5-oxidanylidene-benzo[g][1]benzofuran-3-carboxylate

Systemtic Name: ethyl (4E)-4-[(1,3-benzothiazol-2-ylamino)methylidene]-2-methyl-5-oxidanylidene-benzo[g][1]benzofuran-3-carboxylate Openeye Name: ethyl (4E)-4-[(1,3-benzothiazol-2-ylamino)methylene]-2-methyl-5-oxo-benzo[g]benzofuran-3-carboxylate CAS Name: (4E)-4-[(1,3-benzothiazol-2-ylamino)methylidene]-2-methyl-5-oxo-3-benzo[g]benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl (4E)-4-[(1,3-benzothiazol-2-ylamino)methylidene]-2-methyl-5-oxobenzo[g][1]benzofuran-3-carboxylate Traditional Name: (4E)-4-[(1,3-benzothiazol-2-ylamino)methylene]-5-keto-2-methyl-benzo[g]benzofuran-3-carboxylic acid ethyl ester Formula: C24H18N2O4S MolecularWeight: 430.47572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C(=CNC3=NC4=CC=CC=C4S3)C(=O)C5=CC=CC=C52)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1/C(=C\NC3=NC4=CC=CC=C4S3)/C(=O)C5=CC=CC=C52)C

InChI

InChI=1S/C24H18N2O4S/c1-3-29-23(28)19-13(2)30-22-15-9-5-4-8-14(15)21(27)16(20(19)22)12-25-24-26-17-10-6-7-11-18(17)31-24/h4-12H,3H2,1-2H3,(H,25,26)/b16-12+