ethyl 2-[6-bromanyl-2-(3-oxidanylidenebenzo[f]chromen-2-yl)carbonylimino-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[6-bromanyl-2-(3-oxidanylidenebenzo[f]chromen-2-yl)carbonylimino-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[6-bromo-2-(3-oxobenzo[f]chromene-2-carbonyl)imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-bromo-2-[oxo-(3-oxo-2-benzo[f][1]benzopyranyl)methyl]imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-bromo-2-(3-oxobenzo[f]chromene-2-carbonyl)imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[6-bromo-2-(3-ketobenzo[f]chromene-2-carbonyl)imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C25H17BrN2O5S MolecularWeight: 537.38188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)Br)SC1=NC(=O)C3=CC4=C(C=CC5=CC=CC=C54)OC3=O

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)Br)SC1=NC(=O)C3=CC4=C(C=CC5=CC=CC=C54)OC3=O

InChI

InChI=1S/C25H17BrN2O5S/c1-2-32-22(29)13-28-19-9-8-15(26)11-21(19)34-25(28)27-23(30)18-12-17-16-6-4-3-5-14(16)7-10-20(17)33-24(18)31/h3-12H,2,13H2,1H3