ethyl 2-[2-[(3-oxidanylidenebenzo[f]chromen-1-yl)methylsulfanyl]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[(3-oxidanylidenebenzo[f]chromen-1-yl)methylsulfanyl]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[(3-oxobenzo[f]chromen-1-yl)methylsulfanyl]thiazol-4-yl]acetate CAS Name: 2-[2-[(3-oxo-1-benzo[f][1]benzopyranyl)methylthio]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[(3-oxobenzo[f]chromen-1-yl)methylsulfanyl]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[(3-ketobenzo[f]chromen-1-yl)methylthio]thiazol-4-yl]acetic acid ethyl ester Formula: C21H17NO4S2 MolecularWeight: 411.49398

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)SCC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)SCC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3

InChI

InChI=1S/C21H17NO4S2/c1-2-25-18(23)10-15-12-28-21(22-15)27-11-14-9-19(24)26-17-8-7-13-5-3-4-6-16(13)20(14)17/h3-9,12H,2,10-11H2,1H3