ethyl 2-[5-chloranyl-4-methyl-2-(2-phenoxyethanoylimino)-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[5-chloranyl-4-methyl-2-(2-phenoxyethanoylimino)-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[5-chloro-4-methyl-2-(2-phenoxyacetyl)imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[5-chloro-4-methyl-2-(1-oxo-2-phenoxyethyl)imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-chloro-4-methyl-2-(2-phenoxyacetyl)imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[5-chloro-4-methyl-2-(2-phenoxyacetyl)imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C20H19ClN2O4S MolecularWeight: 418.89386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=CC(=C2C)Cl)SC1=NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CN1C2=C(C=CC(=C2C)Cl)SC1=NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C20H19ClN2O4S/c1-3-26-18(25)11-23-19-13(2)15(21)9-10-16(19)28-20(23)22-17(24)12-27-14-7-5-4-6-8-14/h4-10H,3,11-12H2,1-2H3