ethyl 2-(3,4-dimethoxyphenyl)carbonylimino-3-ethyl-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 2-(3,4-dimethoxyphenyl)carbonylimino-3-ethyl-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-(3,4-dimethoxybenzoyl)imino-3-ethyl-1,3-benzothiazole-6-carboxylate CAS Name: 2-[(3,4-dimethoxyphenyl)-oxomethyl]imino-3-ethyl-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(3,4-dimethoxybenzoyl)imino-3-ethyl-1,3-benzothiazole-6-carboxylate Traditional Name: 3-ethyl-2-veratroylimino-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C21H22N2O5S MolecularWeight: 414.47478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC)SC1=NC(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC)SC1=NC(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H22N2O5S/c1-5-23-15-9-7-14(20(25)28-6-2)12-18(15)29-21(23)22-19(24)13-8-10-16(26-3)17(11-13)27-4/h7-12H,5-6H2,1-4H3