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

Systemtic Name: ethyl 4-[[4-(6-bromanyl-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]-ethanoyl-amino]benzoate Openeye Name: ethyl 4-[acetyl-[4-(6-bromo-2-oxo-chromen-3-yl)thiazol-2-yl]amino]benzoate CAS Name: 4-[acetyl-[4-(6-bromo-2-oxo-1-benzopyran-3-yl)-2-thiazolyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[acetyl-[4-(6-bromo-2-oxochromen-3-yl)-1,3-thiazol-2-yl]amino]benzoate Traditional Name: 4-[acetyl-[4-(6-bromo-2-keto-chromen-3-yl)thiazol-2-yl]amino]benzoic acid ethyl ester Formula: C23H17BrN2O5S MolecularWeight: 513.36048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H17BrN2O5S/c1-3-30-21(28)14-4-7-17(8-5-14)26(13(2)27)23-25-19(12-32-23)18-11-15-10-16(24)6-9-20(15)31-22(18)29/h4-12H,3H2,1-2H3