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

Systemtic Name: ethyl 2-[5-chloranyl-2-(2-methoxyphenyl)carbonylimino-4-methyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[5-chloro-2-(2-methoxybenzoyl)imino-4-methyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[5-chloro-2-[(2-methoxyphenyl)-oxomethyl]imino-4-methyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-chloro-2-(2-methoxybenzoyl)imino-4-methyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-(5-chloro-4-methyl-2-o-anisoylimino-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)C3=CC=CC=C3OC

Isomeric SMILES

CCOC(=O)CN1C2=C(C=CC(=C2C)Cl)SC1=NC(=O)C3=CC=CC=C3OC

InChI

InChI=1S/C20H19ClN2O4S/c1-4-27-17(24)11-23-18-12(2)14(21)9-10-16(18)28-20(23)22-19(25)13-7-5-6-8-15(13)26-3/h5-10H,4,11H2,1-3H3