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

Systemtic Name: methyl 2-[5-chloranyl-4-methyl-2-(2-phenoxyethanoylimino)-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C19H17ClN2O4S MolecularWeight: 404.86728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N(C(=NC(=O)COC3=CC=CC=C3)S2)CC(=O)OC)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N(C(=NC(=O)COC3=CC=CC=C3)S2)CC(=O)OC)Cl

InChI

InChI=1S/C19H17ClN2O4S/c1-12-14(20)8-9-15-18(12)22(10-17(24)25-2)19(27-15)21-16(23)11-26-13-6-4-3-5-7-13/h3-9H,10-11H2,1-2H3