(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 2-(1,3-thiazol-4-ylmethylsulfanyl)benzoate

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 2-(1,3-thiazol-4-ylmethylsulfanyl)benzoate Openeye Name: (7-methoxy-2-oxo-chromen-4-yl)methyl 2-(thiazol-4-ylmethylsulfanyl)benzoate CAS Name: 2-(4-thiazolylmethylthio)benzoic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl 2-(1,3-thiazol-4-ylmethylsulfanyl)benzoate Traditional Name: 2-(thiazol-4-ylmethylthio)benzoic acid (2-keto-7-methoxy-chromen-4-yl)methyl ester Formula: C22H17NO5S2 MolecularWeight: 439.50408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC=CC=C3SCC4=CSC=N4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC=CC=C3SCC4=CSC=N4

InChI

InChI=1S/C22H17NO5S2/c1-26-16-6-7-17-14(8-21(24)28-19(17)9-16)10-27-22(25)18-4-2-3-5-20(18)30-12-15-11-29-13-23-15/h2-9,11,13H,10,12H2,1H3