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

Systemtic Name: ethyl 2-[2-(3,4-dimethoxyphenyl)carbonylimino-6-sulfamoyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-(3,4-dimethoxybenzoyl)imino-6-sulfamoyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[(3,4-dimethoxyphenyl)-oxomethyl]imino-6-sulfamoyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(3,4-dimethoxybenzoyl)imino-6-sulfamoyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-(6-sulfamoyl-2-veratroylimino-1,3-benzothiazol-3-yl)acetic acid ethyl ester Formula: C20H21N3O7S2 MolecularWeight: 479.52664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)N)SC1=NC(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)N)SC1=NC(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H21N3O7S2/c1-4-30-18(24)11-23-14-7-6-13(32(21,26)27)10-17(14)31-20(23)22-19(25)12-5-8-15(28-2)16(9-12)29-3/h5-10H,4,11H2,1-3H3,(H2,21,26,27)