ethyl 2-[6-ethoxy-2-[(7-ethoxy-1-benzofuran-2-yl)carbonylimino]-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[6-ethoxy-2-[(7-ethoxy-1-benzofuran-2-yl)carbonylimino]-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[6-ethoxy-2-(7-ethoxybenzofuran-2-carbonyl)imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-ethoxy-2-[(7-ethoxy-2-benzofuranyl)-oxomethyl]imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-ethoxy-2-(7-ethoxy-1-benzofuran-2-carbonyl)imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[6-ethoxy-2-(7-ethoxybenzofuran-2-carbonyl)imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C24H24N2O6S MolecularWeight: 468.52216

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC4=C(O3)C(=CC=C4)OCC)S2)CC(=O)OCC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC4=C(O3)C(=CC=C4)OCC)S2)CC(=O)OCC

InChI

InChI=1S/C24H24N2O6S/c1-4-29-16-10-11-17-20(13-16)33-24(26(17)14-21(27)31-6-3)25-23(28)19-12-15-8-7-9-18(30-5-2)22(15)32-19/h7-13H,4-6,14H2,1-3H3