ethyl 4-[[2-[4-(6-bromanyl-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]-2-cyano-ethenyl]amino]benzoate

Systemtic Name: ethyl 4-[[2-[4-(6-bromanyl-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]-2-cyano-ethenyl]amino]benzoate Openeye Name: ethyl 4-[[2-[4-(6-bromo-2-oxo-chromen-3-yl)thiazol-2-yl]-2-cyano-vinyl]amino]benzoate CAS Name: 4-[[2-[4-(6-bromo-2-oxo-1-benzopyran-3-yl)-2-thiazolyl]-2-cyanoethenyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[4-(6-bromo-2-oxochromen-3-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl]amino]benzoate Traditional Name: 4-[[2-[4-(6-bromo-2-keto-chromen-3-yl)thiazol-2-yl]-2-cyano-vinyl]amino]benzoic acid ethyl ester Formula: C24H16BrN3O4S MolecularWeight: 522.37054

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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=C(C=CC(=C4)Br)OC3=O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC4=C(C=CC(=C4)Br)OC3=O

InChI

InChI=1S/C24H16BrN3O4S/c1-2-31-23(29)14-3-6-18(7-4-14)27-12-16(11-26)22-28-20(13-33-22)19-10-15-9-17(25)5-8-21(15)32-24(19)30/h3-10,12-13,27H,2H2,1H3