ethyl 2-[6-ethoxy-2-(phenylcarbonylimino)-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[6-ethoxy-2-(phenylcarbonylimino)-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-(2-benzoylimino-6-ethoxy-1,3-benzothiazol-3-yl)acetate CAS Name: 2-(2-benzoylimino-6-ethoxy-1,3-benzothiazol-3-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(2-benzoylimino-6-ethoxy-1,3-benzothiazol-3-yl)acetate Traditional Name: 2-(2-benzoylimino-6-ethoxy-1,3-benzothiazol-3-yl)acetic acid ethyl ester Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N2O4S/c1-3-25-15-10-11-16-17(12-15)27-20(22(16)13-18(23)26-4-2)21-19(24)14-8-6-5-7-9-14/h5-12H,3-4,13H2,1-2H3