ethyl 2-[(3Z)-3-[[(4-methoxyphenyl)amino]methylidene]-4-oxidanylidene-chromen-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[(3Z)-3-[[(4-methoxyphenyl)amino]methylidene]-4-oxidanylidene-chromen-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[(3Z)-3-[(4-methoxyanilino)methylene]-4-oxo-chroman-2-yl]sulfanylacetate CAS Name: 2-[[(3Z)-3-[(4-methoxyanilino)methylidene]-4-oxo-3,4-dihydro-2H-1-benzopyran-2-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[(3Z)-3-[(4-methoxyanilino)methylidene]-4-oxochromen-2-yl]sulfanylacetate Traditional Name: 2-[[(3Z)-4-keto-3-(p-anisidinomethylene)chroman-2-yl]thio]acetic acid ethyl ester Formula: C21H21NO5S MolecularWeight: 399.46014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1C(=CNC2=CC=C(C=C2)OC)C(=O)C3=CC=CC=C3O1

Isomeric SMILES

CCOC(=O)CSC1/C(=C\NC2=CC=C(C=C2)OC)/C(=O)C3=CC=CC=C3O1

InChI

InChI=1S/C21H21NO5S/c1-3-26-19(23)13-28-21-17(12-22-14-8-10-15(25-2)11-9-14)20(24)16-6-4-5-7-18(16)27-21/h4-12,21-22H,3,13H2,1-2H3/b17-12-