ethyl 2-[6-chloranyl-2-(2,3-dimethoxyphenyl)carbonylimino-4-methyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[6-chloranyl-2-(2,3-dimethoxyphenyl)carbonylimino-4-methyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[6-chloro-2-(2,3-dimethoxybenzoyl)imino-4-methyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-chloro-2-[(2,3-dimethoxyphenyl)-oxomethyl]imino-4-methyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-chloro-2-(2,3-dimethoxybenzoyl)imino-4-methyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-(6-chloro-4-methyl-2-o-veratroylimino-1,3-benzothiazol-3-yl)acetic acid ethyl ester Formula: C21H21ClN2O5S MolecularWeight: 448.91984

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21ClN2O5S/c1-5-29-17(25)11-24-18-12(2)9-13(22)10-16(18)30-21(24)23-20(26)14-7-6-8-15(27-3)19(14)28-4/h6-10H,5,11H2,1-4H3