ethyl 2-[2-(1-benzofuran-2-ylcarbonylimino)-6-methylsulfanyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[2-(1-benzofuran-2-ylcarbonylimino)-6-methylsulfanyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-(benzofuran-2-carbonylimino)-6-methylsulfanyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[2-benzofuranyl(oxo)methyl]imino-6-(methylthio)-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(1-benzofuran-2-carbonylimino)-6-methylsulfanyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-(benzofuran-2-carbonylimino)-6-(methylthio)-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C21H18N2O4S2 MolecularWeight: 426.50862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)SC)SC1=NC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)SC)SC1=NC(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C21H18N2O4S2/c1-3-26-19(24)12-23-15-9-8-14(28-2)11-18(15)29-21(23)22-20(25)17-10-13-6-4-5-7-16(13)27-17/h4-11H,3,12H2,1-2H3