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

Systemtic Name: [7-(ethoxycarbonylamino)-2-oxidanylidene-chromen-4-yl]methyl 2-(1,3-benzothiazol-2-ylsulfanyl)ethanoate Openeye Name: [7-(ethoxycarbonylamino)-2-oxo-chromen-4-yl]methyl 2-(1,3-benzothiazol-2-ylsulfanyl)acetate CAS Name: 2-(1,3-benzothiazol-2-ylthio)acetic acid [7-(ethoxycarbonylamino)-2-oxo-1-benzopyran-4-yl]methyl ester IUPAC Name: [7-(ethoxycarbonylamino)-2-oxochromen-4-yl]methyl 2-(1,3-benzothiazol-2-ylsulfanyl)acetate Traditional Name: 2-(1,3-benzothiazol-2-ylthio)acetic acid [7-(carbethoxyamino)-2-keto-chromen-4-yl]methyl ester Formula: C22H18N2O6S2 MolecularWeight: 470.51812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H18N2O6S2/c1-2-28-21(27)23-14-7-8-15-13(9-19(25)30-17(15)10-14)11-29-20(26)12-31-22-24-16-5-3-4-6-18(16)32-22/h3-10H,2,11-12H2,1H3,(H,23,27)