(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 2-(1,3-benzothiazol-2-ylsulfanyl)ethanoate

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 2-(1,3-benzothiazol-2-ylsulfanyl)ethanoate Openeye Name: (7-methoxy-2-oxo-chromen-4-yl)methyl 2-(1,3-benzothiazol-2-ylsulfanyl)acetate CAS Name: 2-(1,3-benzothiazol-2-ylthio)acetic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl 2-(1,3-benzothiazol-2-ylsulfanyl)acetate Traditional Name: 2-(1,3-benzothiazol-2-ylthio)acetic acid (2-keto-7-methoxy-chromen-4-yl)methyl ester Formula: C20H15NO5S2 MolecularWeight: 413.4668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H15NO5S2/c1-24-13-6-7-14-12(8-18(22)26-16(14)9-13)10-25-19(23)11-27-20-21-15-4-2-3-5-17(15)28-20/h2-9H,10-11H2,1H3