ethyl 4-[[2-cyano-2-[4-(2-oxidanylidenechromen-3-yl)-1,3-thiazol-2-yl]ethenyl]amino]benzoate

Systemtic Name: ethyl 4-[[2-cyano-2-[4-(2-oxidanylidenechromen-3-yl)-1,3-thiazol-2-yl]ethenyl]amino]benzoate Openeye Name: ethyl 4-[[2-cyano-2-[4-(2-oxochromen-3-yl)thiazol-2-yl]vinyl]amino]benzoate CAS Name: 4-[[2-cyano-2-[4-(2-oxo-1-benzopyran-3-yl)-2-thiazolyl]ethenyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-cyano-2-[4-(2-oxochromen-3-yl)-1,3-thiazol-2-yl]ethenyl]amino]benzoate Traditional Name: 4-[[2-cyano-2-[4-(2-ketochromen-3-yl)thiazol-2-yl]vinyl]amino]benzoic acid ethyl ester Formula: C24H17N3O4S MolecularWeight: 443.47448

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C24H17N3O4S/c1-2-30-23(28)15-7-9-18(10-8-15)26-13-17(12-25)22-27-20(14-32-22)19-11-16-5-3-4-6-21(16)31-24(19)29/h3-11,13-14,26H,2H2,1H3